Unnamed: 0 int64 0 1.72k | enzyme_class stringclasses 1
value | pollutant stringclasses 39
values | sequence stringlengths 79 1.81k | reactant_descriptors stringclasses 19
values | reactant_smiles stringclasses 19
values | uniprot_ids stringlengths 6 10 | product_smiles stringclasses 86
values | product_descriptors stringclasses 86
values |
|---|---|---|---|---|---|---|---|---|
0 | ligase | Atrazine | MSQRSLADWLGYLEQLHPSAIDMGLERSREVAVRLGLGRPAPRVVTVTGTNGKGSTCAFLAELLGEQGLKVGVYASPHLLRYNERVLIQGREASDEALCEAFAAVEAARGEISLTYFEMGTLAAFWLFERAGLDAVVLEVGLGGRLDAVNLVDADVAVVTSIGLDHAEWLGDNRDSVAFEKAGIFRAGKPAVCGDLEPPQPLLDQARALGAPLLLRGRDFDLAIGEHDWHWHGRGADGTPLRLHHLSLLDLPMENAALALQVYALLGLPWQPERLLAALLRTRVSGRLDRRVATWQGQSRHLLLDVGHNPHAADYLARRL... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D1I6 | ['C1[C@@H](NC2=C(N1)N=C(NC2=O)N)CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O', 'C1[C@@H](NC2=C(N1)N=C(NC2=O)N)CN(C=O)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N', 'C1[C@@H](NC2... | [[277.96, 574.5510000000004, -0.9323999999999946, 10, 11, 14, 2, 0.375, 144.66249999999997, 0], [352.64, 731.6760000000004, -2.0318999999999905, 11, 13, 20, 2, 0.4, 178.38329999999985, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0], [286.23999999999995, 602.5610000000005,... |
1 | ligase | Atrazine | MPKRTDIKSILILGAGPIVIGQACEFDYSGAQACKALKEEGFRVILVNSNPATIMTDPAMADATYIEPIKWQTVAKIIEKERPDALLPTMGGQTALNCALDLERHGVLEKFGVEMIGANADTIDKAEDRSRFDKAMKAIGLACPRSGIAHSMEEAYGVLEQVGFPCIIRPSFTMGGTGGGIAYNREEFEEICARGLDLSPTNELLIDESLIGWKEYEMEVVRDKKDNCIIVCSIENFDPMGVHTGDSITVAPAQTLTDKEYQIMRNASLAVLREIGVETGGSNVQFGICPDTGRMVVIEMNPRVSRSSALASKATGFPIA... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D8I8 | ['C(=O)(N)OP(=O)(O)O', 'C(CC(=O)O)[C@@H](C(=O)O)N', 'OP(=O)(O)O', 'N', 'C(=O)(N)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N', 'C(=O)(O)OP(=O)(O)O'] | [[109.85000000000002, 141.019, -0.8255999999999999, 3, 3, 1, 0, 0.0, 22.7125, 0], [100.61999999999999, 147.13, -0.736899999999999, 3, 3, 4, 0, 0.6, 32.480999999999995, 0], [77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [35.0, 17.031, 0.16199999999999998, 1, 1, 0, 0, 0.0, 5.0221, 0], [63.3... |
2 | ligase | Atrazine | MTRYIFVTGGVVSSLGKGIASASLAAILEARGLKITMLKLDPYINVDPGTMSPFQHGEVFVTHDGAETDLDLGHYERFVRTTMTQNNNFTTGRVYMDVLRKERRGDYLGATVQVIPHITDEIKRRIIKGAGDADVALVEVGGTVGDIESQPFLEAIRQLRVEIGSRRAMLMHLTLVPYIATAGETKTKPTQHSVKELRSIGLQPDVLVCRSDHPVDVSSRRKIALFTNVEERAVISLEDVDTIYRIPSVLHAQGLDDIVVERFGLECGPADLSEWDRVVDAKLNPEREVTIAMVGKYMELLDAYKSLIEAMTHAGIQSRT... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A127MXV5 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N', 'OP(=O)(O)O', 'N', 'C(CC(=O)O)[C@@H](C(=O)O)N', 'C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O'] | [[232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0], [77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [35.0, 17.031, 0.16199999999999998, 1, 1, 0, 0, 0.0, 5.0221, 0], [100.61999999999999, 147.13, -0.736899999999999, 3, 3, 4, 0, 0.6, 32.480999999999995... |
3 | ligase | Atrazine | MPMSLNQLLPQAEAGVLIRELTLDSRAVKPGDLFLAIPGAQHDGRAHIADAVARGAAAIAYEAEGASVAPIGDTPLVAIKGLAAQLSAIAGRFYGEPSRGIELIGVTGTNGKTSVSQLLAQALDLLGQRCGIVGTLGNGFHDALESGKHTTPDALALQATLARLKQAGARAVAMEVSSHGLEQGRVAALEFDVAVFTNLSRDHLDYHGTMEAYGAAKARLFAWPGLKCRVINLDDAFGRQLAGEAHPSRLMGYSLEDASAFLYCREARFSDAGVEALLVTPKGEGVLRSSLLGRFNLSNLLAVVGALLGLDYPLGDILKL... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5DCT1 | ['OP(=O)(O)O', 'C[C@@H](C(=O)N[C@H](CCC(=O)N[C@@H](CCC[C@H](C(=O)O)N)C(=O)O)C(=O)O)NC(=O)[C@@H](C)O[C@@H]1[C@H]([C@H](O[C@@H]([C@H]1O)CO)OP(=O)(O)OP(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=CC(=O)NC3=O)O)O)NC(=O)C\nC[C@H](C(=O)NC(CCC(=O)N[C@@H](CCC[C@H](C(=O)O)N)C(=O)O)C(=O)O)NC(=O)[C@@H](C)O[C@@H]1[C@H]([C@H](O[C@@H](... | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [520.0800000000002, 1051.7960000000003, -6.231200000000003, 15, 23, 27, 1, 0.6857142857142857, 224.1460999999996, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0]] |
4 | ligase | Atrazine | MPHAFFITGTDTEIGKTTIAAGLLHAARMAGMSTAAAKPVASGCERRPEGLRNGDALALLGECSLPLAYEEVNPFAFEPAIAPHLAAREVGVALNVDTLAGPVRHVLARGADFTLVEGAGGWRVPLAGEESLSDLAIRLDLPVILVVGVRLGCINHAVLSAEAILRDGLPLAGWVANIVDPRTSRLEENLATLAERLPAPCIGRVPHLAAPTPMAVAAHLDLGILDLPD | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5CXF0 | ['OP(=O)(O)O', 'CC(C(CCCCCC(=O)O)NC(=O)O)N', 'CC1C(NC(=O)N1)CCCCCC(=O)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [112.65, 232.28000000000003, 1.0049000000000003, 4, 3, 8, 0, 0.8, 59.31870000000003, 0], [78.43, 214.26499999999996, 1.0914, 3, 2, 6, 0, 0.8, 55.638200000000026, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0... |
5 | ligase | Atrazine | MHIHILGICGTFMGSLAVLAKELGHRVTGSDANVYPPMSTQLQAQGIELMQGYEPAHLEPAPDLVVIGNALSRGNPAVEYVLNKGLPYVSGPQWLADHVLQGRWVLAAAGTHGKTTTSSMLAWVLEHAGMSPGFLIGGVPQNFGVSARLGGTPFFVVEADEYDSAFFDKRSKFVHYRPRTAILNNLEFDHADIFPDLAAIERQFHHLVRTIPGEGLIIHPENETALKRVIGMGCWTPVQTTGEGGQWQARLLSADGSRFEVLFDGAAQGTVEWELTGQHNVANALACLAAARHVGVVPELGCAALSAFKSVKRRMEKVAE... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5CXW0 | ['OP(=O)(O)O', 'C[C@@H](C(=O)N[C@H](CCC(=O)N[C@@H](CCC[C@H](C(=O)O)N)C(=O)O)C(=O)O)NC(=O)[C@@H](C)O[C@@H]1[C@H]([C@H](O[C@@H]([C@H]1O)CO)OP(=O)(O)OP(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=CC(=O)NC3=O)O)O)NC(=O)C\nC[C@H](C(=O)NC(CCC(=O)N[C@@H](CCC[C@H](C(=O)O)N)C(=O)O)C(=O)O)NC(=O)[C@@H](C)O[C@@H]1[C@H]([C@H](O[C@@H](... | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [520.0800000000002, 1051.7960000000003, -6.231200000000003, 15, 23, 27, 1, 0.6857142857142857, 224.1460999999996, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0]] |
6 | ligase | Atrazine | MSKPTADSKEATVAANFLRPIVQADLDSGKHQKIVTRFPPEPNGYLHIGHAKSICLNFGLARDFGGDCHLRFDDTNPAKEDQEYIDAIEADVKWLGFQWAGPVRFASDYFDQLHAWAVDLIKAGKAFVCDLNAEEMRQYRGSLTEPGRNSPFRERSVEENLDLFARMKAGEFPDGAKSLRAKIDMASPNINLRDPILYRIRHAHHHQTGDKWCIYPSYDFTHGQSDAIEGITHSICTLEFEDHRPLYEWFLANLPVPAQPRQYEFARLNLNYTITSKRKLKQLVDEGHVDGWDDPRMSTLSGYRRRGYTPASIRNFCDMI... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5CZM9 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
7 | ligase | Atrazine | MGKLRVGVIFGGRSAEHEVSLQSAKNIVDALDRSRFEPVLIGIDKDGRWHLNDASDYLLNQENPALIALNRSNRELAVVPGKAERQLVETGSRQLLDHVDVIFPIVHGTQGEDGCLQGLLRMADIPFVGADVLGSAICMDKDVSKRLLRDAGIAITPFITLTRATAARTPFAEAQRQLGLPLFVKPANLGSSVGVSKVEDEAGYVAAVQQALAFDDKVLVEAAVNGREIECAVLGNDEPIASGCGEIVVRGGFYSYDSKYIDEDAARVVVPADIDAAACERIRQLAVEAFQVLGCSGLARVDVFLTGDGQVLVNELNSLP... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D3G4 | ['OP(=O)(O)O', 'C[C@H](C(=O)N[C@H](C)C(=O)O)N', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [92.42, 160.17299999999997, -1.0770999999999993, 3, 3, 3, 0, 0.6666666666666666, 38.8899, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0]] |
8 | ligase | Atrazine | MSAASVYPVRPEVAANTLTDEASYKKLYQQSVVNPDGFWREQAQRVEWIKPFTKVKQTSFDDHHVDIKWFADGTLNVSYNCLDRHLAERGDQLAIIWEGDDPSEHQEITYRQLHEQVCKFANALRGQDVHRGDVVTIYMPMIPEAVVAMLACTRIGAIHSVVFGGFSPEALAGRIIDCRSKIVITADEGVRGGKKTPLKANVDDALTNPETNSVQKIIVCKRTGSDIKWNAHRDVWYEDLMKVAGTTCAPKEMGAEDPLFILYTSGSTGKPKGVLHTTGGYLVYASLTHERVFDYRPGEVFWCTADIGWVTGHSYVVYGP... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D423 | ['CCC(=O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O', 'CC(=O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O', 'CCC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O', 'OP(=O)(O)OP(=O)(O)O', 'C1=NC(=C2C(=N1)N(C=... | [[192.14, 403.2880000000001, -0.9021000000000001, 4, 12, 6, 2, 0.5384615384615384, 87.81930000000003, 0], [192.14, 389.26100000000014, -1.2922, 4, 12, 5, 2, 0.5, 83.20230000000002, 0], [363.63000000000005, 823.6050000000002, -0.9252999999999965, 9, 19, 20, 2, 0.6666666666666666, 177.38909999999973, 0], [124.29000000000... |
9 | ligase | Atrazine | MKSAEIREAFLRFFEEKGHTRVASSSLIPANDPTLLFTNAGMNQFKDCFLGLEKRAYTRATTSQKCVRAGGKHNDLENVGYTARHHTFFEMLGNFSFGDYFKRDAIHYAWEFLTSDKWLNLPKDKLWVTVYASDDEAYDIWTQEVGVPAERMVRIGDNKGAPYASDNFWAMGDTGPCGPCTEIFYDHGADIWGGPPGSPEEDGDRYIEIWNNVFMQFNRTADGVMHPLPAPSVDTGMGLERISAVLQHVHSNYEIDLFQSLLKASAEAIGCANDDAPSLKVVADHIRSCSFLIADGVLPSNEGRGYVLRRIIRRACRHGN... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D446 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
10 | ligase | Atrazine | MTRARQCPALLIAAPASGQGKTTVTAALARLHARQGRRVRVFKVGPDFLDPMILARASGAPVHQLDLWMVGEAQSRRLLWEAAGEAELILIEGVMGLFDGTPSAADLARTFDVPVLGVINGQAMAQTFGALAVGLATYQPGLPFSGVLGNRVGSQRHSDLLRDSLPEWIRWYGALPRSADLELPSRHLGLVQAEELADLDARLDAAADALAASSAVDLPPPVSFAAPTEHELQASLAGVRIGVARDAAFAFLYQANLDLLRELGAELKFFSPLTGEYLPEVDSLYLPGGYPELHLAQLENNRAMAEAIRAHHAAGKPLLA... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D473 | ['C/C/1=C/2\\[C@@]([C@@H](/C(=C/C3=N/C(=C(\\C4=NC([C@@H]([C@@]4(C)CCC(=O)O)CC(=O)O)[C@]5([C@@]([C@@H](C1=N5)CCC(=O)O)(C)CC(=O)N)C)/C)/[C@H](C3(C)C)CCC(=O)O)/N2)CCC(=O)O)(C)CC(=O)N'] | [[321.78999999999996, 879.0209999999996, 4.720800000000005, 8, 11, 18, 0, 0.6444444444444445, 230.5334999999994, 0]] |
11 | ligase | Atrazine | MTTQTAAQRIAQLRSELDAHNYRYYVLDEPSVPDAEYDRLFRELKELEAEHPDLVTPESPTQRVGGAAASAFGEIRHEIPMLSLGNAFEEQDLLDFDRRVREGLADLLPGGDLLGGGAEVDYSCEPKLDGLAVSLLYENGRLTRGATRGDGSTGEDISANVRTVRNIPLRLHGEGWPAVLEVRGEVFMSKAGFEALNARQMEAGAKTFANPRNAAAGSLRQLDPKITASRPLELCAYGFGRVEGGSLPDTQIGILEAFKAWGIPVSRELKLARGVKGCQDYYADIGERRDSLAYEIDGVVFKVNRIDFQRELGFRAREPR... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D4A4 | ['C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)[O-])O)O)C(=O)N', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N'] | [[166.25000000000003, 334.221, -2.8304999999999985, 4, 7, 5, 1, 0.45454545454545453, 66.85580000000003, 0], [186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0]] |
12 | ligase | Atrazine | MTQKKAVILLSGGLDSATVVAMAKAEGYACYSMSFDYGQRHRAELQAAERVARQLGVVEHKVIGLNLDGIGGSALTDSSIAVPEAPSEGIPVTYVPARNTVFLSLALGWAEVLGARDIFIGVNAVDYSGYPDCRPDFVEAFERMANLATKAGVEGDGFRIQAPLQFLSKAQIIQAGVARGVDYALTVSCYQADDAGRACGKCDSCRLRAEGFAAAGISDPTRYF | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D4C6 | ['OP(=O)(O)O', 'O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0]] |
13 | ligase | Atrazine | MTTVRTRIAPSPTGDPHVGTAYIALFNLCFARQHGGKFILRIEDTDQVRSTRESEQQIFDALRWLGIEWDEGPDVGGPHGPYRQSERGAIYKRYSDELVEKGHAFPCFCSAERLDAIRAEQQARKETPRYDGHCMHLPKEESQRRIAAGESHVVRMKVPTEGVCVVPDMLRGDVEIPWDRMDMQVLMKADGLPTYFLANVVDDHLMGITHVLRGEEWLPSAPKLIKLYEYFGWEQPVLCYMPLLRNPDKSKLSKRKNPTSITFYERMGFLPQALLNYLGRMGWSMPDEREKFSLQEMIDNFDLSRVSLGGPIFDMEKLSW... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A9K8F3 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
14 | ligase | Atrazine | MNLHEYQGKQLFAEYGLPVSKGFAVDTPEEAAEACEKIGGTEWVVKAQVHAGGRGKAGGVKLVKSKEDAKAFAANWLGKRLVTYQTDANGQPVSKILVESCTDIDKELYLGAVVDRSSRRIVFMASTEGGVDIEKVAHDTPEKILKATIDPLVGAQPFQGRELAFQLGLKGDQIKQFVHIFVGLAKLFQDYDLALLEVNPLVIKKDGNLHCLDAKINIDSNALYRQPKLRAMHDPSQDDAREAHAQKWELNYVALEGNIGCMVNGAGLAMGTMDIVNLHGGKPANFLDVGGGATKERVTEAFKIILSDSNVAAVLVNIFG... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A127MRD7 | ['OP(=O)(O)O', 'CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)CCC(=O)O)O', 'CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)CC(=C)C(=O)O)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([... | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [400.92999999999995, 867.614, -1.4704999999999948, 10, 20, 22, 2, 0.64, 183.9678999999998, 0], [400.92999999999995, 879.625, -1.3043999999999958, 10, 20, 22, 2, 0.5769230769230769, 188.4908999999998, 0], [232.59999999999997, 427.203000000000... |
15 | ligase | Atrazine | MSILINKDTKVICQGFTGSQGTFHSEQAIAYGTKMVGGVTPGKGGTTHLGLPVFDTVKQAVEATGAEASVIYVPAPFCKDSILEAAFGGIKLIVCITEGIPTLDMLDAKVKCDELGVRLIGPNCPGVITPGECKIGIMPGHIHLPGKVGIVSRSGTLTYEAVKQTTDAGFGQSTCVGIGGDPIPGSNFIDILKLFQEDPKTEAIVMIGEIGGSAEEEAAAYIKANVTKPVVSYIAGVTAPPGKRMGHAGAIISGGKGTADEKFAALQDAGVKTVRSLADIGKALAELTGWATK | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A127MRJ7 | ['OP(=O)(O)O', 'CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)CCC(=O)O)O', 'CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)CC(=C)C(=O)O)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([... | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [400.92999999999995, 867.614, -1.4704999999999948, 10, 20, 22, 2, 0.64, 183.9678999999998, 0], [400.92999999999995, 879.625, -1.3043999999999958, 10, 20, 22, 2, 0.5769230769230769, 188.4908999999998, 0], [232.59999999999997, 427.203000000000... |
16 | ligase | Atrazine | MADVKKVVLAYSGGLDTSVILKWLQDTYNCEVVTFTADLGQGEEVEPARAKAKALGVKEIYIEDLREEFVRDFVFPMFRANTIYEGEYLLGTSIARPLIAKRLIEIANETGADAISHGATGKGNDQVRFELGAYALKPGVKVIAPWREWDLLSREKLMDYAETHGIPIERHGKKKSPYSMDANLLHISYEGGVLEDTWTEHEEDMWKWTVSPEKAPDAPTYIELTYRKGDIVAIDGKEMTPAQVLTELNRIGGANGIGRLDIVENRYVGMKSRGCYETPGGTIMLKAHRAIESITLDREVAHLKDELMPRYAKLIYTGYW... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D5Q8 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'C(C[C@@H](C(=O)O)N)CN=C(N)N[C@@H](CC(=O)O)C(=O)O', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [188.32999999999996, 290.276, -1.9892999999999965, 6, 5, 9, 0, 0.6, 68.14690000000002, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
17 | ligase | Atrazine | MSENRQILVTSALPYANGSIHLGHMLEYIQTDIWVRFQKMRGNQAVYVCADDAHGSAIMLRAEREGITSEQLIDAVRAEHMADFAAFLVDFDNYHSTHSEENRELSSAIYLKLRDAGHIATRPVTQYFDPEKQMFLADRFIKGTCPKCGTADQYGDNCEACGATYAPTELKDPKSAISGATPVLKESLHYFFKLPDFDAMLKQWTRSGALQESVANKIAEWLDAGLQEWDISRDAPYFGFEIPEAPGKYFYVWLDAPIGYMASFKNLCARRPELDFDAFWNKDSKAELYHFIGKDIVNFHALFWPAMLEGAGYRKPTALN... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D5T9 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
18 | ligase | Atrazine | MRSHYCGQLNESLDGQEVTLCGWVHRRRDHGGVIFLDIRDREGLAQVVFDPDRAETFAKADRVRSEYVVKVTGKVRMRPEGARNANMASGAIEVLGYELDVLNQAETPPFPLDEYSDVGEETRLRYRFIDLRRPEMAAKLKLRARITSSIRRYLDDNGFLDVETPILGRPTPEGARDYLVPSRTYPGHFFALPQSPQLFKQLLMVAGFDRYYQIAKCFRDEDLRADRQPEFTQIDIETSFLDESDIIAITEKMVRQLFKEVLDVEFDEFPHMPFEEAMRRYGSDKPDLRIPLELVDVADQLKDVEFKVFSGPANDPKGRV... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D6M2 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
19 | ligase | Atrazine | MPEAGSSLGFRELGVLPYEPTWHAMQRFTAERDEGTPDEVWLLEHERVFTQGQAGKAEHVLMPGDIPVVKVDRGGQVTYHGPGQLVAYLLLDVRRSHLGVRELVTRIEQSLIGLLEGFGVSAVSKPDAPGVYVDGAKIASLGLRIRNGRSFHGLALNVDMDLEPFRRINPCGYAGMAMTQLRELAGPITLAEVRKRLRGELTERLGYAEQKTLTGGIELR | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D7P2 | ['B1(OC(C(O1)(C)C)(C)C)C2=C(C=C(C=C2)Cl)Cl', 'CC(=NC1=NN=C(C=C1)Cl)N(C)C'] | [[18.46, 272.96799999999996, 3.292600000000002, 0, 2, 1, 1, 0.5, 72.17800000000004, 0], [41.38, 198.65699999999998, 1.7414999999999998, 0, 3, 1, 1, 0.375, 53.498000000000026, 0]] |
20 | ligase | Atrazine | MNTVKTVRELRAAVARARGEGKRIALVPTMGNLHAGHAALVAKAGQRADFVVASIFVNPLQFGPNEDLDKYPRTLAADQARLLEAGCHLLFAPGVEEMYPDGMQGQTKVSVPGVSEGLCGGSRPGHFDGVATVVCKLLNMVQPDMALFGEKDFQQLAVIRKLVRDLNIPVQIFGEPTVRAEDGLALSSRNGYLNDDERARAPVIQRTLRQLAEALRGGSRDFPALLEEGRRQIEAAGLRVDYLEIREALSLRPADAGDRQVVVLAAAFLGKTRLIDNLPLQLD | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D7W6 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'CC(C)(CO)[C@H](C(=O)NCCC(=O)O)O', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [106.86000000000001, 219.23699999999997, -1.0432999999999986, 4, 4, 6, 0, 0.7777777777777778, 52.13610000000003, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
21 | ligase | Atrazine | MTDYKATLNLPDTQFPMKAGLPQREPETLKFWNDIGLYQKLRKAGEGRPKFILHDGPPYANGSIHIGHAVNKILKDLIVRSRTLAGYDAPYVPGWDCHGLPIEHKVETTHGKNLPADKTRELCRAYASEQIEGQKADFIRLGVLGEWDNPYKTMNFANEAGEIRALAEMVRQGFVFKGLKPVNWCFDCGSALAEAEVEYADKKSDAIDVAFPVEDEGKLAAAFGLQSLAKPAAIVIWTTTPWTIPANQALNVHPEFTYALVDTGERLLVLAEELVESCLQRYGLEGQVIATAKGEALDLIRFRHPFYERFSPVYLAEYVA... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D842 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
22 | ligase | Atrazine | MFEITAHPVPDAVRQRAYLDEEGYRRLYRQSIEQPDVFWGEQAKALLDWFKPWHSVHHGDLARGQASWFKGGQLNVAYNCIDRHLEQRGEQVAIIWEGDNPAESAHITYRKLHSHVCRLANVLKSRGVEKGDRVCIYMPMIPEAAYAMLACARIGAIHSVVFGGFSPDSLRDRILDADCRTVITADEGVRGGKYIPLKQNVEKALQDCPNVSTVVVVQRTQGKVPWVEGRDLWYHETLHGVSEDCPPEPMDAEDPLFILYTSGSTGKPKGVLHTTGGYLLGAAMTHKYVFDYHEGDIYWCTADVGWVTGHSYIVYGPLAN... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D8G3 | ['CCC(=O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O', 'CC(=O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O', 'CCC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O', 'OP(=O)(O)OP(=O)(O)O', 'C1=NC(=C2C(=N1)N(C=... | [[192.14, 403.2880000000001, -0.9021000000000001, 4, 12, 6, 2, 0.5384615384615384, 87.81930000000003, 0], [192.14, 389.26100000000014, -1.2922, 4, 12, 5, 2, 0.5, 83.20230000000002, 0], [363.63000000000005, 823.6050000000002, -0.9252999999999965, 9, 19, 20, 2, 0.6666666666666666, 177.38909999999973, 0], [124.29000000000... |
23 | ligase | Atrazine | MPRIGTPLSPTATRVLLCGSGELGKEVVIELQRLGCEVIACDRYANAPAMQVAHRSHVLSMLDGAALRAVIEQEKPHYIVPEIEAIATATLVELEAEGYTVVPTARAAQLTMNREGIRRLAAEELGLPTSPYHFADTYEDYVAGAAAVGYPCVVKPIMSSSGKGQSVLKSDAELKAAWDYAQEGGRAGKGRVIVEGFIDFDYEITLLTVRHVGGTTFCAPIGHRQVKGDYHESWQPQAMSPKALAESERVAKAVTEALGGRGLFGVELFVKGDQVWFSEVSPRPHDTGLVTLISQDLSEFALHARAILGLPIPAIRQFGP... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D931 | ['OP(=O)(O)O', 'C([C@@H]1[C@H]([C@H]([C@@H](O1)NC(=O)CNC=O)O)O)OP(=O)(O)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [174.65, 314.187, -3.595399999999998, 6, 7, 7, 0, 0.75, 60.88010000000003, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0]] |
24 | ligase | Atrazine | MKTIQDDIAKDLNVQRPFATEADVQAEIQRRIRFIQDCLRESGTRTLVLGISGGVDSLTAGMLCQRAVEGLREETGNSDYRFIAVRLPYNVQGDESDAQAAVDCIAPDERHTVNIGPAVQALAEQTRALDGLPAATVDFALGNTKARMRMVAQYTIANARQGLVVGTDHAAEAVMGFFTKFGDGACDIAPLTGLVKHQVRTIARTLGAPEFLVEKVPTADLEDLAPGKPDEHAHGVTYQEIDAFLHGQPVSPEAFEIIKRTYEKTHHKRQLPKAP | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D9Q4 | ['C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[318.25999999999993, 664.4380000000001, -3.0158999999999976, 8, 17, 11, 3, 0.47619047619047616, 139.37710000000013, 1], [186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
25 | ligase | Atrazine | MGKNVVVLGTQWGDEGKGKIVDLLTDQAAAVVRYQGGHNAGHTLVIDGEKTVLHLIPSGILREGVQCLIGNGVVLAPDALMREIAKLEEKGVPVRERLRISPSCPLILSFHVALDQAREKARGDAKIGTTGRGIGPAYEDKVARRGLRVADLFHRERFAAKLGELLDYHNFVLQNYYKEPAVDFQKTLDECMGYAEQLKPLLADVTSTLHDLRRASQNIMFEGAQGSLLDIDHGTYPFVTSSNTTAGGTATGSGFGPLFLDYILGITKAYTTRVGSGPFPTELFDEVGAYLAKKGHEFGATTGRARRCGWFDAVILRRAI... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A127N0J9 | ['OP(=O)(O)O', 'C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N=C(NC2=O)N', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N[C@@H](CC(=O)O)C(=O)O'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [252.57, 443.20200000000006, -2.452699999999999, 7, 12, 6, 2, 0.5, 87.3911, 0], [246.67999999999995, 463.29600000000016, -2.1053999999999986, 7, 12, 9, 2, 0.5, 96.54200000000004, 0]] |
26 | ligase | Atrazine | MDKTYQPHAIESHWYPTWEQNNYFAPQGSGEPYTIMIPPPNVTGSLHMGHGFNNAIMDALIRYRRMQGRNTLWQPGTDHAGIATQMVVERQLAAQGIARHDLGREKFLEKVWEWKEQSGGTITRQIRRLGSSVDWSRERFTMDDGLSNAVKEAFVRLFDDGLIYRGKRLVNWDTKFHTAISDLEVENHDEKGHLWHLRYPLADGHKTADGKDHLVVATTRPETLLGDSAVAVHPEDERYQALIGTFVELPLVGRRIPIIADDYVDREFGTGCVKITPAHDFNDYEVGKRHDLPLINIFDKDAAVLATAQVFKLDGSVNPD... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5DAC1 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
27 | ligase | Atrazine | MLILRGAPALSAFRHGKLLDLLTRQVPAVTGLYAEFAHFAEVSGVLTADEEQVLGRLLKYGPSVPVQEPKGRLFLVVPRFGTISPWSSKATDIAHNCGLAKLERIERGIAYYVAGELSEADAAQVAARLHDRMTQLVLNQMEEAAGLFSHAQPKPLTVVDILGGGRAALEKANLELGLALAEDEIDYLVKSFVELGRNPHDVELMMFAQANSEHCRHKIFNASWDIDGQAQDKSLFGMIKNTYEMHREGVLSAYKDNAAVMVGSVAGRFYPNPETRQYGASEEPVHILMKVETHNHPTAIAPFPGASTGSGGEIRDEGAT... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5DAG4 | ['OP(=O)(O)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N', 'C(CC(=O)O)[C@@H](C(=O)O)N', 'C([C@@H]1[C@H]([C@H]([C@@H](O1)/N=C(/CNC=O)\\N)O)O)OP(=O)(O)O'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0], [100.61999999999999, 147.13, -0.736899999999999, 3, 3, 4, 0, 0.6, 32.480999999999995, 0], [183.92999999999998, 313.20300000000003, -3.354399999999997... |
28 | ligase | Atrazine | MKIGVIGGGQLGRMLSLAGTPLGMDFAFLDPAPDACAQALGEHIRADYSDQDHLRQLADEVDLVTFEFESVPAETVAFLSQFVPVYPSASALRIARDRWFEKSMFKDLGIPTPAFADIQSQADLDAAAAGIGLPAVLKTRTLGYDGKGQKVLRKPEDVAGAFAELGSVPCILEGFVPFTGEVSLVAVRARDGETRFYPLVHNTHENGILRLSVASSEHPLQKLAEDYVGRVLDKLDYVGVLAFEFFEVDGGLKANEIAPRVHNSGHWTIEGAECSQFENHLRAVAGLPLGSTAKVGESAMLNFIGEVPPVEKVLAIADCH... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5DB18 | ['OP(=O)(O)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0]] |
29 | ligase | Atrazine | MNDALKSTLEPRAFGRVAVLYGGKSAEREVSLKSGGMVLKALQDAGVDAFGIDVGDDLLQRLLSEKIDRAFIILHGRGGEDGSMQGLLEVAGIPYTGSGVLASALAMDKLRTKRVWLSLGLPTPAYAVLASEDDCRRAAAELGFPLIVKPAHEGSSIGMAKVDGVDALIAAWRSAAEYDSQVLVEQWISGPEFTVATLRGQVLPAIGLGTPHSFYDYDAKYLASDTQYRIPCGLSPEKERELQDLCARACEALGIQGWGRTDVMQDAEGRFWLLEVNTAPGMTDHSLVPMAARAAGLDFQQLVLAILADSVEARG | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5DBC7 | ['OP(=O)(O)O', 'C[C@H](C(=O)N[C@H](C)C(=O)O)N', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [92.42, 160.17299999999997, -1.0770999999999993, 3, 3, 3, 0, 0.6666666666666666, 38.8899, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0]] |
30 | ligase | Atrazine | MSLIASDNFRIVVGLGKSGMSLVRFLARQGVPFAVADTRENPPELATLRAQYPQVEVRCGELDAGFLCRASELYVSPGLSLRTPALVEAAARGVRLSGDIDLFARHAKAPIVAITGSNAKSTVTTLVGEMAVAAGKRVAVGGNLGTPALDLLADDVELYVLELSSFQLETCERLGAEVATCLNVSEDHMDRYDGMADYHLAKHRIFRGARQVVVNRADALSRPLIADSVPCWTFGTNKPDFKAFGLVEEGGEKYLAFQFEALMPVRELKIRGAHNQSNALAALALGHAVGLPFEPMLRTLREFAGLAHRCQWVGERAGVS... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5DCS8 | ['OP(=O)(O)O', 'C[C@@H](C(=O)N[C@H](CCC(=O)O)C(=O)O)NC(=O)[C@@H](C)O[C@@H]1[C@H]([C@H](O[C@@H]([C@H]1O)CO)OP(=O)(O)OP(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=CC(=O)NC3=O)O)O)NC(=O)C', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [427.66, 879.6120000000003, -5.298199999999992, 12, 20, 20, 1, 0.6785714285714286, 182.75319999999974, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0]] |
31 | ligase | Atrazine | MTTRILTGITTTGTPHLGNYAGAIRPAIVASRDPQADSFYFLADYHALIKCDDPLRIQRSRLEIAATWLALGLDTDKATFYRQSDIPEIPELTWLLTCVSAKGLLNRAHAYKASVDKNVEAGEDPDAGVSMGLYSYPILMAADILMFNAHKVPVGRDQIQHVEMARDIGQRFNHLFGNGKELFTLPEVVIEEEVATLPGLDGRKMSKSYDNTIPLFGSSKQLKDAIARIVTDSRAPGEPKDPDNSHLFTLYQAFATPAQLAEFRAALLEGLAWGEAKQRLYELLEAELGEARERYHTLIARPGDLEDILLAGAAKARRIA... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5DCV1 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
32 | ligase | Atrazine | MLDSKLVRTQPQEVADRLAARGFTLDVARIEALENQRKAVQTRTETLQAERNARSKAIGQAMKRGEDVEPLKAEVNRMADELEAGKRELDGIQAELDALLLTIPNLPHESVPVGADEEDNLEVRRWGTPRSFDFPIQDHVALGEQHGWLDFETAARLSGARFALMRGPIARLHRALAQFMIDLHTREHGYEEAYTPYLVQAPALQGTGQLPKFEEDLFKIGRDGEADLYLIPTAEVSLTNIVAGQILDAKELPLKFVAHTPCFRSEAGASGRDTRGMIRQHQFDKVEMVQIVEPTKSWEALESLVGNAEKVLQALELPYR... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5DD52 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
33 | ligase | Atrazine | MKSVEEQLALIKRGADELLVEAELVEKLKRGQPLRIKAGFDPTAPDLHLGHTVLINKLRQFQDLGHQVIFLIGDFTGMIGDPSGKSATRPPLTREQVLENAETYKSQVFKILDPAKTEVAFNSTWMDKLTPADFIRLASQYTVARMLERDDFSKRYASNQSIAIHEFLYPLVQGYDSVALRADVELGGTDQKFNLLMGRELQRAYDQEPQCILTMPLLEGLDGVKKMSKSLGNYIGIQEAPGVMYSKLVSIPDTLMWRYFELLSFRSMDEIDALRKDVEAGANPRDVKIKLAEEIVARFHGEEVAANAHKSAGNRLKEGE... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5DEA3 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
34 | ligase | Atrazine | MTSAFLSHLQTELSGLKTAGLYKSERVITSTQGAEIEVGGEKVLNFCANNYLGLADSHELRDAAKSALDRYGYGMASVRFICGTQEEHKQLEAKLSGFLGMEDTILYSSCFDANAGLFETLLGEEDAIISDALNHASIIDGVRLSKARRFRYANNDMAALEEELKKAEGSRFKLIATDGVFSMDGIIANLKGVCDLADRYGAMVMVDDSHAVGFVGRNGRGTPEHCGVEGRVDIITGTLGKALGGASGGYTSGRREVVDWLRQRSRPYLFSNTLAPSITGASIRVLELIAEGADLRQKLYANAERFRAGMGKLGFKLAGA... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A7L8RXL9 | ['CC(=O)[C@@H](C(=O)O)N', 'CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCS)O'] | [[80.39, 117.104, -1.0126999999999995, 2, 3, 2, 0, 0.5, 26.292199999999998, 0], [346.55999999999995, 767.5410000000002, -1.6652999999999962, 10, 18, 18, 2, 0.6666666666666666, 163.4860999999999, 0]] |
35 | ligase | Atrazine | MNQDFLSHISNVLQGIETDGLYKRERHISGMQAGRIKVKGPDGERQMVNLCANNYLGLADNADIRKAAATALDEFGFGMASVRFICGTQTLHRELEHAISDYLGKDDAILFAACFDANGALFEPLLGAEDAIISDSLNHASIIDGVRLSKAKRFRYAQGDMDDLETQLKQAAVDGARFKLVVTDGVFSMDGHVAKLKQICDLAERYGAIVAVDDCHATGHIGEEGRGTPALTGAGNRVDIVTGTLGKTLGGAMGGFIAASQPIIDLLRQRARPYLFSNSLAPAVAAGSLKAIEIARGADDLRAKLGRHTTRFRDGLTEAG... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A7L8S2F8 | ['CC(=O)[C@@H](C(=O)O)N', 'CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCS)O'] | [[80.39, 117.104, -1.0126999999999995, 2, 3, 2, 0, 0.5, 26.292199999999998, 0], [346.55999999999995, 767.5410000000002, -1.6652999999999962, 10, 18, 18, 2, 0.6666666666666666, 163.4860999999999, 0]] |
36 | ligase | Atrazine | MSYKSHQLIKDHDVKWVDLRFTDTKGKQQHVTMPARDALDDDFFEAGKMFDGSSIAGWKGIEASDMILLPDDSTAVLDPFTEEPTLILVCDIIEPSTMQGYERDPRNIAKRAEEYLKSTGIGDTVFVGPEPEFFIFDEVKFKSDISGSMFKIFSEQASWNTDADIESGNKGHRPGVKGGYFPVPPVDHDHEIRTAMCNALEEMGLVVEVHHHEVATAGQNEIGVKFNTLVAKADEVQTLKYCVHNVADAYGKTVTFMPKPLYGDNGSGMHVHMSISKDGKNTFAGEGYAGLSDTALYFIGGIIKHGKALNGFTNPSTNSY... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A127N1A1 | ['OP(=O)(O)O', 'C(CC(=O)N)[C@@H](C(=O)O)N', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [106.41, 146.146, -1.336199999999999, 3, 3, 4, 0, 0.6, 34.03959999999999, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0]] |
37 | ligase | Atrazine | MTTRDDRIDCPDWPEAYVQRYRDAGYWREETFSGLLREAARRFAEREALVEGERRLSYRELDARVDRLAAGLHGLGLRAGDNVLLQLPNGIAFVEACFALYRLGARPIFALPAHRELELSSFCRFAGARAYICADRAADFDFRALARRLQAEQPQLRHVLVAGEAQEFVALADLYRAEPLALPEPAPEAVACFQLSGGSTGVPKLIPRRHREYLYNLRASAELCGLGPDSTYLAALPMAHNFPMCCPGFMGTLYSGGRVVTAAQPTPECCFPLVEAEGVSHTALVPPLALVWMEAAELRGRGLPGLLLQVGGARLSEAAA... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5CXK7 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'C1=CC=C(C(=C1)C(=O)S)O', 'C1=CC=C(C(=C1)C(=O)OP(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C(N=CN=C43)N)O)O)O', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [37.3, 154.19, 1.4621999999999997, 2, 2, 1, 1, 0.0, 41.42330000000001, 0], [212.36999999999998, 467.33100000000013, -0.292700000000001, 5, 13, 6, 3, 0.29411764705882354, 104.95860000000002, 0], [124.29000000000002, 177.973, -0.81160000000000... |
38 | ligase | Atrazine | MIENILAEIHKASTIEELNTLRVKYLGKSGLITRELSRLKELPEAERASVAAGLNELKRNCLGAIEIQKDNLATAARLQALNDQSVDVTLPGAALSCGGLHPLTRTIGRLLDIFQSLGYEVIAGPELESDHYNFKSLNFPDDHPARDTQDTFWTHDGRLLRTHTSSVQVRYMETHAPPFRVVSPGKVFRNEAVDQTHEAQFHQLEALVVGEGLSMSDLRGAISAVATALFGDSAKTRLQPSYFPFVEPGAEFSVWWHNPRSGQQEWLELGGCGMVHPNVLEGVGYRNVSGFAFGLGIERLAMIAYGIPDIRYFHQNDTRF... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5CXZ7 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
39 | ligase | Atrazine | MKFGADMSPGMKLDWPPEVVFELEVTPNRADALSILGVARDLAAKLQIPYKNPAPAPASAPQKPLRLYTDALCKRLVASSIDEVRPAPSPIWLQRRLVALGLAPENNVSDITRYVTFELGQPLQAYDRKQDMISIAVRRASPKESLELGNGTTVQLTSSDMVVSAQLSSRRHEVIGLAGVVVGMSRKINDSTTSLLLEAANYDAQAVRRCARRHKLGSDAQYRFERGVDPNLAPIALARAAALIVELAGGNRSECIVDTGTDVIRAPIHYRPSRLLQIAALDVPEEIQQRLLGRLGCVISPAKWTWEVIPPTWRFDLQHE... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5CY43 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
40 | ligase | Atrazine | MNIHALRNELDMLGVELWEENGLLRYRAPAGALDEALLQRLRQARDELLRALAAEREQALQGDPAEQGEPFPLTDVQAAYLLGRSTAFAHGGVACHGYLEFAFPGLEVARLERAWNQLIERHPMLRAVVSAEGHQRILAEVPYYRLAEHRLDAEGRRLAELRERMELRRAGPDCWPLVELCVSHGAAGDFLHLSVDLLVCDYQSVRMLLGELHQLYHGGTLAEPARISFRDYVLAERRLREGPRYGRDRDYWLARIDGLPGAPELPLADAQPGARFRRLALQVDERDYRALGLNAAGAGIGVSAAVLAAYAETLGRWSRR... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5CYA2 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OC(=O)[C@H](CS)N)O)O)N', 'C([C@@H](C(=O)S)N)S', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [218.16, 450.3700000000002, -2.0549999999999984, 6, 14, 7, 2, 0.5384615384615384, 99.35670000000002, 0], [43.09, 137.229, -0.3000999999999997, 3, 3, 2, 0, 0.6666666666666666, 35.8214, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4,... |
41 | ligase | Atrazine | MALSVYNTLSKAKEPFQPLVGNQVRMYVCGMTVYDFCHIGHARVMVAFDVIARWLRQRGYELTYVRNITDIDDKIIRRAQENGEPFDALTERMIAAMHEDEARLSVLRPDVEPRATGHIAGMHAMIQTLIDKGFAYAPGNGDVYYRVGKFVGYGKLSRKKIEDLRIGARIEVDESKEDPLDFVLWKAAKPGEPSWESPWGAGRPGWHIECSVMSTCCLGETFDIHGGGPDLVFPHHENEIAQSEAATGKPYAATWMHAGAVRVDGEKMSKSLGNFFTIREVLEKYHPEVVRFLLVSSHYRSPINYSEDNLKEAKGALERF... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D0A5 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
42 | ligase | Atrazine | MSVRLGIVMDPIASINFKKDSSLAMLLAAQARGWTLFYMEQQDLYQKANAARAKIRPLKVFDDAERWYELDQEIDLPLAELDVILMRKDPPFNNEYIYSTYLLEQAERAGTLVVNRPQSLRDCNEKFFATLFPQCTPPTLVTRRADILREFAAEHRDIILKPLEGMGGTMIFRHREGDPNLSVILETLTLHGHQQIMAQRYIPEIKDGDKRILMIDGEPVEYCLARIPAQGETRGNLAAGGRGVAQPLTERDRWIAQQVGPQLRERGLLFVGLDVIGDYLTEINVTSPTCIREIDKAYDTRIGERLMDAIEGKLKARAAA... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0AAQ1KQ26 | ['OP(=O)(O)O', 'CC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N', 'C(CC(=O)N[C@@H](CS)C(=O)NCC(=O)O)[C@@H](C(=O)O)N', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [158.82, 289.288, -1.7258999999999975, 5, 5, 9, 0, 0.6363636363636364, 67.71240000000002, 0], [158.82000000000002, 307.32800000000003, -2.2060999999999984, 6, 6, 9, 0, 0.6, 71.27440000000003, 0], [232.59999999999997, 427.2030000000001, -1.74... |
43 | ligase | Atrazine | MKDTIRQLIQHALASLVEDGTLPAGLSPDIQVETTKDRSHGDYASNIAMMLAKPAGLKPRDLATKLVAALPANPQVAKVEIAGPGFLNFFQDQAWLAASLDAALGDDRLGVRKAGPAQRVAIDMSSPNLAKEMHVGHLRSTIIGDAVARVLEFLGDTVIRQNHVGDWGTQFGMLLAYLEEQPVDAQAELHDLEVFYRAAKKRFDESPEFADRARELVVKLQAGDAECLRLWTRFNEISLSHCQKVYDQLGVKLTMADVKGESAYNDDLANVVDELKAKGLLTEDDGALCVFLDEFKNAEGNPLPVIVQKAGGGYLYATTD... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D0J6 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
44 | ligase | Atrazine | MPVTAESHVAAQFAARGYRNVHDLLRDASREHPERPAFSCAGSCLSFAELERQADAFARYLRHCAGLQPGERLALMLPNSLQYPIAAFGALKAGLVLVNTNPQYTAGELSHQLRDSGAVAILLLDRLLPLLRKVQGDSAVRQVLLTSVEDMETPQYVCDEPDATRFMQALRLGAEAPPLDAEPGLERLALLQYTGGTTGVSKGAMLSHYNLLANVIQTLELFMRPGLLDPASDVRIAPLPLYHIMAFSTNCLSSVAMGLHTVVIRDGRNLDEIIEAMRRYPFSLLSGLNSLFVGLMNHPAFASLDFSHLKWVTSGGAPLN... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D0L5 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'CCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [363.63000000000005, 1005.9560000000005, 4.146000000000006, 9, 19, 33, 2, 0.7837837837837838, 237.4100999999994, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
45 | ligase | Atrazine | MSDLLSRRLALLGDAANLPLLSQCLHGIERECLRVDGNGRLALSPHPKALGSALTNPQITTDYSEALLEFITPTSTGVEQTLASLESIHRFASQRLDGELLWSPSMPCELPDEESIPIARYGSSNIGRLKYVYRKGLALRYGKTMQCIAGIHYNFSLPEGLWQLLQRHEDGGMALRDFQSAHYIALIRNFRRYSWLLMYLFGASPALDAGFLRGRPHQLQQFDEHTLYLPWATSLRMSDLGYQNNAQAGLTPCYNDLESYVESLRSAVGTPYPPYQKIGTKQDGEWVQLNTNVLQIENEYYSSIRPKRVTYSGERPIQAL... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D151 | ['OP(=O)(O)O', 'CC[C@@H](C(=O)O)NC(=O)CC[C@@H](C(=O)O)N', 'C(CC(=O)N[C@@H](CS)C(=O)O)[C@@H](C(=O)O)N', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [129.72, 232.23599999999996, -0.8420999999999985, 4, 4, 7, 0, 0.6666666666666666, 54.702700000000014, 0], [129.72, 250.27599999999998, -1.3222999999999985, 5, 5, 7, 0, 0.625, 58.26470000000001, 0], [232.59999999999997, 427.2030000000001, -1.... |
46 | ligase | Atrazine | MASDTPSLEEYARRRDFSGTPEPRGEAPGHQAGELEFVVQKHDASHLHYDFRLELDGVLKSWAVPKGPCLDPSVKRLAIEVEDHPLEYAGFEGHIPEGHYGAGDVIVWDRGRWQPLGDPRQGLENGHLKFRLEGSKLHGSWNLIRTRMAGRKPQWFLVKGRDDQARDFPRHDILAEAPQSVLSGRTLPGEAAPAQKPADPPRRAAAAKAPRRKAAKAGAMPERISPELATLLDAPPEGDWRYELKLDGYRILARVEKGEVRLQTRNGHDWAERLPDICAALRALPLQSAWLDGEILVVDEEGRPDFQRLQNAFDVGASDE... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D1D9 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
47 | ligase | Atrazine | MVATPAHPPARFGIEEEAFLVDGASLDLARQVPPEWAQACRRALGNCFAEEMFQCQAELVSPVFRQLGEAAAFLARARAQLSELARAHGLRSLVVGAHPFSRLADAAPSEPAHYRALFEDYVQPARNSLLCGLHVHVEVPPGLDRVALMNRVLPWAPLLLALSCSSPFWQGRHTGLASYRRALSGQWPRMDIPPWFDDEPAYQAYLKLLHTRGLMREPGHAWWFVRPSARYPTLELRISDACPRLADALCIAGLFRALLTQAMADADAEEPHRLRALLAENYWQAQRHGCRARFLLADGDCVDLARWLELAWAQCGATAR... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D1V6 | ['OP(=O)(O)O', 'CC[C@@H](C(=O)O)NC(=O)CC[C@@H](C(=O)O)N', 'C(CC(=O)N[C@@H](CS)C(=O)O)[C@@H](C(=O)O)N', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [129.72, 232.23599999999996, -0.8420999999999985, 4, 4, 7, 0, 0.6666666666666666, 54.702700000000014, 0], [129.72, 250.27599999999998, -1.3222999999999985, 5, 5, 7, 0, 0.625, 58.26470000000001, 0], [232.59999999999997, 427.2030000000001, -1.... |
48 | ligase | Atrazine | MKFSEQWLRSWVNPQVSRDELVARLSMAGLEVDAVIPVAGAFSGVVVGEVLSTEQHPDADKLRVCQVSNGSETFQVVCGAPNVRPGLKIPFAMIGAELPGDFKIKKAKLRGVESNGMLCSAKELEISDDNAGLMELAADAPVGASIRDYLELDDASIEIGLTPNRGDCLSLTGLAREVGALYSAPVTFVDVKPVAPGIDDVRPIELLAPSACPRYLGRVIRNVDLSKPTPLWMVERLRRSDIRSIDAAVDITNYVMLELGQPMHAFDLDEIKGGIRVRMAEEGEKLVLLDGQEVALRTDTLVIADHERALAMAGVMGGEH... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D2Q6 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
49 | ligase | Atrazine | MIDNFWKDKYPAGIAAEINADQYPNILAVLKESCQRFANKPAFSNLGKTLTYGDLYRLSGDFAAYLQNDTDLQPGDRIAVQLPNVLQYPIVVFGAMRAGLIVVNTNPLYTAREMEHQFNDSGAKALVCLANMAHLAEEVLPRTGIRHVLITEVADLLPPLKRLLINAVVKYVKKMVPAYHIGNAVKLNDALAKGRGKSVRESSPKSDDVAVLQYTGGTTGVAKGAMLTHRNLVANMLQCKALMGANLNEGCEILIAPLPLYHIYAFTFHCMAMMLTGNHNILVTNPRDLNAFSKELAQWKFTGFVGLNTLFVGLCNNEAF... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D310 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'CCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [363.63000000000005, 1005.9560000000005, 4.146000000000006, 9, 19, 33, 2, 0.7837837837837838, 237.4100999999994, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
50 | ligase | Atrazine | MENLDALVSQALEAVRHTEDVNALEQIRVHYLGKKGELTQVMKTLGDLPAEERPKVGALINVAKEKVQEALNARKTDLEGAALAAKLAAERVDVTLPGRGQTSGGLHPVTRTKERIEQCFTRIGYEVAEGPEVEDDYHNFEALNIPGHHPARAMHDTFYFNANMLLRTHTSPVQVRTMESQRPPIRIVCPGRVYRCDSDLTHSPMFHQVEGLLIDEDVSFADLKGTIEEFLRAFFEKEFSVRFRPSFFPFTEPSAEVDIQCVLCSGKGCRVCKQTGWLEVMGCGMVHPNVLRMSGIDPEKYQGFAFGMGIERLAMLRYGV... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A127MWN3 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
51 | ligase | Atrazine | MSQTTPAVRTFQDLILALQQYWADQGCVVLQPYDMEVGAGTFHTATFLRAIGPETWNAAYVQPSRRPTDGRYGENPNRLQHYYQFQVVLKPNPENFQELYLGSLKAIGIDPLVHDIRFVEDNWESPTLGAWGLGWEIWLNGMEVTQFTYFQQVGGIECYPVTGEITYGLERLAMYIQGVDSVYDLVWADGPFGKVTYGDVFHQNEVEQSTYNFEHANVEKLFELFDFYESEANRLIELQLPLPTYEMVLKASHTFNLLDARRAISVTERQRYILRVRTLARNVAQSYLQARARLGFPMATPELRDEVLAKLKEAE | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D3C2 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
52 | ligase | Atrazine | MSAKDFLVELGTEELPPKALKSLGEAFLAGIEKGLKAAGLTYSAARYYAAPRRLAVQIDQLAVQQPDRTVNLDGPPLQAAFDASGNPTQAALGFAKKCGVDLAQIDQSGPKLKFSQSIPGQPAVGLLPGIVETSLNDLPIPKRMRWAARREEFVRPTQWLVMLFGDEVVECEILTRKAGRESRGHRFHNPDNVLISSPANYLEDLRSAHVLADFAERREIIAKRVAELAAEQKGSAIVPPALLDEVTALVEWPVPLVCSFEERFLAVPQEALITTMQDNQKYFCLLDASGKLLPRFITVANVQSKAPEHIVSGNEKVVRP... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D3E8 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
53 | ligase | Atrazine | MQAEFWNDKRPAGVPSQLDLGAYKSVVEVFERSCKRFADRPVFSNMGVTLTYAELDRLSAAFAAYLQRNTDLKPGERIAVQMPNILQYPIAVFGALRAGLVVVNTNPLYTAREMRHQFKDSGARALVYVNLFGKLVQEVLPDTGIEYLIEAQMGDLQPALKGLLVNAAVKYVKKMVPDYRLPQAVPFKEVLRQGRGHALQPVKVGLEDLAVLQYTGGTTGVAKGAMLTHGNLVANMLQVDACLSQHGPDGRPLMNEGGEVMIAPLPLYHIYAFTANCMCMMHNGNHNVLISNPRDIPGFIRELKKWRFSSLLGLNTLFVA... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D3R9 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'CCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [363.63000000000005, 1005.9560000000005, 4.146000000000006, 9, 19, 33, 2, 0.7837837837837838, 237.4100999999994, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
54 | ligase | Atrazine | MSNVESQRRVLSGMRPTGRLHLGHLHGVLRNWVRLQHEYECFFSIVDWHALTTEYDDVGPIRQHVRDMAVDWLAVGVSPSASTLFIQSQVPEHAELHLLLSMICPLPWLERVPTYKELQEKLGHKDLSTYGFLGYPLLQAADILVYRAGLVPVGSDQLAHVEFAREVARRFNHLYGGEVDFEDKAQAAVARLGKKTSKLYGSLRKAWQEQGDEDALETARALLKEQQNLTLGDRERLFGYLEGSSRVLLPEPQTLVGSASRMPGLDGQKMSKSHDNTIGLRESPAEVEEKIARMPTDPARVRRNDPGDPQRCPVWQWHLI... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D411 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
55 | ligase | Atrazine | MIHAQDLSRAALRRLLRQARRKLSAQQQRQAARDLQRRMAQHPLFRRARHIALYLPADGEIDPRPLLEAAQKRGKATYLPVLSRWPHTHMTFQRVGNGERWRKNRYGIAEPLPDRGRQREPWALDLVLLPLVGFDERGGRLGMGKGFYDRTLAYLGRRKIWRKPTLLGLAHECQKVDRLDLASWDVPLQGIVSDAGWYGALA | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D4H8 | ['OP(=O)(O)O', 'C1C2CN(C=[N+]2C3=C(N1)N=C(NC3=O)N)C4=CC=C(C=C4)C(=O)N[C@@H](CCC(=O)O)C(=O)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [193.74999999999997, 456.43900000000025, -0.6134999999999986, 6, 8, 7, 2, 0.3, 117.08000000000007, 1], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0]] |
56 | ligase | Atrazine | MNMYHDAERALLDPLETASLDELRQHQLDRLRWSLKHAYDNVPLYRQRFAEAGVHPDDLKSLDDLAKFPFTGKNDLRDNYPYGMFAVPQSEIVRLHASSGTTGKPTVVGYTQNDIDTWANVVARSIRAAGGRKGDKVHVSYGYGLFTGGLGAHYGAERLGCTVIPMSGGQTEKQVQLIRDFQPDIIMVTPSYMLNLADEIERQGVDPHSLRLRLGIFGAEPWTAELRRAVEERLGITALDIYGLSEIMGPGVAMECAETKDGPTVWEDHFYPEIIDPATGAVLPDGEYGELVFTSLSKEALPMIRYRTRDLTRLLPGTAR... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D549 | ['CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)CC4=CC=CC=C4)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[363.62999999999994, 885.676, -0.09259999999999574, 9, 19, 21, 3, 0.5172413793103449, 197.24409999999972, 0], [186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
57 | ligase | Atrazine | MRKVRKLLRIGLIGDRDSRVTAHWAIPLALQQSLLPHAGALRLEWLDTERLANGLALDAYSGFWCTPGSPYRSTEGALRAITYARTRGVPYLGTCAGFQHALLERARNVLGWDDAAHGEVEPRAARRVIHALPCSLIEVREDIRLQPGSRLAKVYGKPSIREGYRCSYGVNPDYQAALFDSGLHASAHGEDGSIRALEASDHPFFVATLFQPERKALAGVSVPLAEAFLRAANQYARSAA | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D5J7 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N', 'OP(=O)(O)O', 'N', 'C(CC(=O)O)[C@@H](C(=O)O)N', 'C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O'] | [[232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0], [77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [35.0, 17.031, 0.16199999999999998, 1, 1, 0, 0, 0.0, 5.0221, 0], [100.61999999999999, 147.13, -0.736899999999999, 3, 3, 4, 0, 0.6, 32.480999999999995... |
58 | ligase | Atrazine | MQTIRRHQQVQTPWTRSYPAGVRWNTDLSGLSVLDMLDDSVRRWADRPAIDFMGRNIDYRELASLIDRAAKGLQDLGVGPGVHVGLYLPNVPQYVITFFAILRAGGTVVNYSPLDAGEVLAHKIEDSRTDILVTLDLNSLYPLMARLLDSTRLHTLVVGSLGEFGAQPREIRARLQQEGQLAQVHYSEQCLPFEQLLDNEGDWQPHTLPPLDEALAVLQYTGGTTGLPKGAMLTHANLGAAAAQVMMINVDNDQRLHEGRESILVVLPLFHVYAMVGCLLFPVAAGAEMRLHTRFDAGAVLRDIHDNRVSCFPGVPTMFT... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D622 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'CCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [363.63000000000005, 1005.9560000000005, 4.146000000000006, 9, 19, 33, 2, 0.7837837837837838, 237.4100999999994, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
59 | ligase | Atrazine | MRTSQYLLSTLKETPADAVVISHQLLLRAGMIRKLASGLYTWLPMGLRVLRKAETIVREEMNAAGALEVLMPAVQPAELWQESGRWQQYGPELLRLKDRHDREFCVGPTHEEVITDLARNELSSYKQLPINFYQIQTKFRDEIRPRFGLMRGREFIMKDAYSFHMNQESLQQTYDGMYTAYCKIFTRLGLDFRPVQADNGSIGGSGSHEFHVLANSGEDDIVFSDSSDYAANIEKAEAVPRETARGAATEELRLVDTPDTKTIADLVEKFGLPIEKTIKTLVVRGAEEGKLVALVVRGDHELNEIKAANQPLVASPLQMA... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D7B5 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
60 | ligase | Atrazine | MHEQYQPLEIESQAQKYWNEHNSFRVEEVPGKEKFYCLSMFPYPSGKLHMGHVRNYTIGDVISRYQRMQGKNVLQPMGWDAFGMPAENAAMKNNVAPAAWTYDNIAYMKAQLNSLGLAIDWSREVTTCKPDYYRWEQWLFTRLFEKGVIYRKNGTVNWDPVDQTVLANEQVIDGRGWRSGALIEKREIPMYYFKITAYAEELLESLDHLPGWPEQVKTMQRNWIGKSRGMEIAFPYDQASIGEAGQLKVFTTRPDTLMGATYVAVAAEHPLATLAAQREPALQAFIDECKRGGVAEADIATQEKKGVATSLFVEHPLTGE... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D7M5 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
61 | ligase | Atrazine | MSSKQPSLSYKDAGVDIDAGEALVERIKGVAKRTARPEVMGGLGGFGALCEIPAGYKQPVLVSGTDGVGTKLRLALNLNKHDSIGQDLVAMCVNDLVVCGAEPLFFLDYYATGKLNVDVAATVVTGIGAGCELAGCSLVGGETAEMPGMYEGEDYDLAGFCVGVVEKAEIIDGSKVVAGDALVALPSSGPHSNGYSLIRKIIEVSGADIEATQLDGKPLADLLMAPTRIYVKPLLQLIEQTGAVKAMAHITGGGLLDNIPRVLPDNAQAVIDVASWQRPAVFDWLQEKGNVDEHEMHRVLNCGVGMVICVAQDQVEATLA... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A127MY26 | ['OP(=O)(O)O', 'C1=C(N(C=N1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O)N', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [160.29000000000002, 295.188, -1.8062, 5, 8, 4, 1, 0.625, 60.55910000000003, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0]] |
62 | ligase | Atrazine | MPLPSRLLSALAPWRQAPAWRVGFSGGLDSSVLLHLLAQLARTESLPPLSAIHVHHGLQAAADAWPAHCEAFCRELGVPLLVERVTVPTGASLEQAARRARYEAFAKHLKTDDCLLAAQHRDDQAETLLFRLLRGAGVRGLAGIPAARPLGAGMLLRPLLDVPRAELESYAREHGLRWIEDPSNTDTAFARNYLRQRVLPLLAERWPRAVDNIARSAAHLAEAEALLAELAQQDLAAARPGNDFDWLHVPSLALAPLLALGESRQRNALRHWLAPFTPMPDSAHWAGWQALRDAAGDAAPVWRLGGGELQRSGGRLWWLS... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5D9K4 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'O', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
63 | ligase | Atrazine | MKALLASALLLVPSLSLACPDWPEQRAREELLGLRQQLEAWDQAYHQRGESPIADELYDQARQRFSLWRSCYPQLAIEPPPPLPATRGKLRHPAAHTGLDKAADTNEVRQWMAGREDLWVQPKVDGVAVTLVYQDGELVQAISRGDGIRGQDWTANARRLPAVPQRLPATGRLVLQGELYWRLPGHVQAQKGGLGARGKVAGLMARSAPGEQVSQVGLFVWELPHGPGNMTQRLERLRALGLADSAALTLPVTGFEDAQRQREHWYRSPLPFASDGIVLRQGSRPAAKAWQAGSASWALAWKYPYRQALAEVRRVHFRIG... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5DA18 | ['C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)[O-])O)O)C(=O)N', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N'] | [[166.25000000000003, 334.221, -2.8304999999999985, 4, 7, 5, 1, 0.45454545454545453, 66.85580000000003, 0], [186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0]] |
64 | ligase | Atrazine | MSDQQLDQHELQQEENKLIAQRKEKLAAVREAKAIAFPNDFRRDAYFADLQKQYADKTKEELEAAAIPVKVAGRIMLNRGAFIVLQDSSDRLQVYVNRKTLPEETLAEIKTWDLGDIIGAEGTLARSGKGDLYVDMSSVRLLTKSLRPLPDKHHGLTDTEQRYRQRYVDLIVNEETRHTFRVRSQVIAHIRRFLSERGFLEVETPMLQTIPGGAAAKPFATHHNALDMAMFLRIAPELYLKRLVVGGFEKVFEINRNFRNEGVSTRHNPEFTMLEFYQAYADYEDNMDLTEELFRELAQAVLGTTDVPYGDKVFHFGEPF... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5DA47 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
65 | ligase | Atrazine | MLDKVLIANRGEIALRILRACKELGIKTVAVHSTADRELMHLSLADEAVCIGPAPAGQSYLHIPAIIAAAEVTGANGIHPGYGFLAENADFAEQVERSGFTFIGPSADVIRLMGDKVSAKDAMKKAGVPTVPGSDGPLPEDEETALAIAREVGYPVIIKAAGGGGGRGMRVVHSEEELIKSAKLTRTEAGAAFGNSMVYLEKFLTNPRHVEVQVLSDGQGNAIHLGDRDCSLQRRHQKVLEEAPAPGIDEKARAEVLERCVRACVEIGYRGAGTFEFLYENGRFYFIEMNTRVQVEHPVSEMVTGIDIVKEMLRIASGQK... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A127N0X7 | ['OP(=O)(O)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0]] |
66 | ligase | Atrazine | MSKSLQAIRGMNDILPDQTPVWRYLENTFAGLLEEYGYSEIRLPIMEFTELFARGIGEGTDVVDKEMYTFLDRNEESLTLRPEGTAGTVRAMLEHGLTGGGQVQKLWYTGPMFRYEKPQKGRYRQFHQIGVEVFNLPGPDIDAELIILTWRLWQKLGMADAVTLQLNTLGSSEARARYREALVAYLQERFEQLDEDSQRRMTTNPLRILDSKVESTQALLVGAPTLHDYLDEESIAHFEGLKARLDAVGLRYEINQKLVRGLDYYCRTAFEWVTDKLGAQGTVCGGGRYDGLVSQFGGKPTPGVGFAMGVERLVLLLETL... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5DAG0 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
67 | ligase | Atrazine | MSQDIHAHRILILDFGSQYTQLIARRVREIGVYCEIHPFDMSDDDIRAFAPRGIILAGGPESVHELDSPRAPKAVFDLNVPLFGICYGMQTMAEQLGGKVQGSDLREFGYARVDVVGKARLLDGIEDHVDEDGVLGLDVWMSHGDKVTDIPEGFHILASTPSCPIAAMADDARGYYGVQFHPEVTHTKQGGRILSRFVLDICGCEALWTPSNIVNDAIATVRAQVGNAKVLLGLSGGVDSSVVAALLHKAIGDQLTCVFVDNGLLRLHEGDQVMAMFAENMGVKVIRANAEDKFLGRLAGVADPEEKRKIIGRTFIEVFD... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5DAG2 | ['OP(=O)(O)OP(=O)(O)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N=C(NC2=O)N', 'C(CC(=O)O)[C@@H](C(=O)O)N', 'N'] | [[124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0], [186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [206.04000000000002, 363.223, -2.569699999999999, 6, 10, 4, 2, 0.5, 76.48079999999999, 0], [100.61999999999999, 147.13, -0.736899999999999, 3, 3, 4, ... |
68 | ligase | Atrazine | MEKREELYRGKAKSVYTTDDPDRLVLLFRNDTSAFDGKRIEQLDRKGMVNNKFNAFIMQKLEAAGIPTQFDKLLADNEVLVKKLAMIPVECVVRNYAAGSLVRRLGVEEGLQLNPPTFELFLKNDALGDPFINESHVQAFGWATLEQLAQMKAYSFKVNEVLSKLFDDAGLLLVDFKLEFGVFHGQIVLGDEFSPDGCRLWDKETRKKMDKDRFRQGLGGVIEAYEEVAQRLGVPL | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A127MXL9 | ['OP(=O)(O)O', 'C1=NC(=C(N1[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O)N)C(=O)N[C@@H](CC(=O)O)C(=O)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [263.99, 454.28500000000014, -3.1484999999999967, 8, 11, 9, 1, 0.5384615384615384, 91.70190000000002, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0]] |
69 | ligase | Atrazine | MAESAFTPFGVQNLLDTDFYKLSMMQAVLHNYPNVEVEWEFRCRNREDLRPYLARIRERIEALAGLSFSSEQLAFLERIPFFKPDFIRFLGLFRFNMRYVQTGIENDEFFLRLKGPWLHVILFEVPVLASISEARNLQRYPQVTLDLVRERLSDKLDWLRREASAEELAGFKMADFGTRRRFSYAVQECVVRELKASFPGRFVGTSNVHLARKLDLKPLGTMAHEWLMAHQQLGPRLIDSQAAALDAWVREYRGQLGIALTDVITMDAFLRDFDLYFAKLFDGLRHDSGDPLVWAEKAIAHYESLGIDPCSKTLVFSDGL... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5DB95 | ['C1=CC(=CN=C1)C(=O)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O)N', 'O', '[H+]', 'C([C@@H]1[C@H]([C@H]([C@H](O1)OP(=O)(O)OP(=O)(O)O)O)O)OP(=O)(O)O'] | [[50.19, 123.11099999999996, 0.7797999999999998, 1, 2, 1, 1, 0.0, 31.196299999999994, 0], [279.12999999999994, 507.18200000000013, -1.6290000000000004, 7, 14, 8, 2, 0.5, 95.47570000000002, 0], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0], [0.0, 1.008, 0.1125, 0, 0, 0, 0, 0.0, 1.112, 1], [229.73999999999995, 390.... |
70 | ligase | Atrazine | MHQLTLAEVARGLADKQFSAEELTRALLSRIEQLDPQLNSFISVTADEAIAQAKAADQRRANGESGALLGAPIAHKDLFCTKGVRTSCGSKILDNFVSPYDATVVGRLAAAGAVSLGKLNMDEFAMGSANESSHYGAVKNPWDTSRVPGGSSGGSAAAVAARLIPAATGTDTGGSIRQPAALTNLTGIKPTYGRVSRWGMIAYASSLDQAGPLARTAEDCALMLGAMAGFDPKDSTCVDQPLDDYLAALGKPLAGLRIGLPKEYFGAGLDSRIADAVLAVVEQLKQLGAQVKDISLPNMQHAIPAYYVIAPAEASSNLSR... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A1A5DBM4 | ['C(CC(=O)N)[C@@H](C(=O)O)N', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O)N', 'O'] | [[106.41, 146.146, -1.336199999999999, 3, 3, 4, 0, 0.6, 34.03959999999999, 0], [279.12999999999994, 507.18200000000013, -1.6290000000000004, 7, 14, 8, 2, 0.5, 95.47570000000002, 0], [31.5, 18.015, -0.8247, 0, 0, 0, 0, 0.0, 3.6138, 0]] |
71 | ligase | Atrazine | MFKKILIANRGEIACRVIKTAQKLGIATVAVYSDADREALHVKMADEAVHIGPAPSNQSYIVIQKIIDAIRQTGADAVHPGYGFLSENPNFAEALKGEGVAFIGPPPVAIEAMGDKITSKKIAASAGVNTVPGHMGLIEDADEAVKIASSIGYPVMIKASAGGGGKGMRIAWNDTEAREGFQSSRNEAKSSFGDDRIFIEKFVTQPRHIEIQVLGDQHGNLVYLGERECSIQRRNQKVIEEAPSPFLDAATRKAMGEQAVALGKAVGYFSAGTVEFIVDGNRNFYFLEMNTRLQVEHPVTELITGIDLVEEMIRVAAGEK... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A7L8RP70 | ['OP(=O)(O)O', 'C[C@@H](C(=O)O)C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O', 'CC[C@@H](C(=O)O)C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O', 'C1=NC(=C2C(=N1)N(C=N2)[... | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [400.93, 867.6140000000001, -1.6145999999999943, 10, 20, 21, 2, 0.64, 183.89789999999974, 0], [400.93, 881.6410000000002, -1.2244999999999953, 10, 20, 22, 2, 0.6538461538461539, 188.5148999999997, 0], [232.59999999999997, 427.2030000000001, ... |
72 | ligase | Atrazine | MFKKILIANRGEIACRVIQTAKKMGILTVAVYSDADKEARHVELADEAVHIGAAPSRESYLQADRIIAACKQTGAEAVHPGYGFLSENEAFARKVEEEGIAFIGPKHYSIAAMGDKIASKKLANEAQVNTIPGWNDAIETAERAVEIAKDIGYPVMIKASAGGGGKGLRVAFNDKEAFEGFTSCRNEARNSFGDDRVFIEKFVEEPRHIEIQVLGDSHGNVIYLNERECSIQRRHQKVIEEAPSPFITDATRKAMGEQAVQLAKAVKYQSAGTVEFVVGKDQSFYFLEMNTRLQVEHPVTECITGLDLVELMIRVAAGEK... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A7L8SA17 | ['OP(=O)(O)O', 'C[C@@H](C(=O)O)C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O', 'CC[C@@H](C(=O)O)C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O', 'C1=NC(=C2C(=N1)N(C=N2)[... | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [400.93, 867.6140000000001, -1.6145999999999943, 10, 20, 21, 2, 0.64, 183.89789999999974, 0], [400.93, 881.6410000000002, -1.2244999999999953, 10, 20, 22, 2, 0.6538461538461539, 188.5148999999997, 0], [232.59999999999997, 427.2030000000001, ... |
73 | ligase | Atrazine | MTVKRPAPGDLDPIETASRDEIAALQLTRLRATLRNAYDNVPHYRKAFDAKGVHPDDLKSLADLSKFPFTVKTDLRDNYPFGMFAVPRTQVARIHASSGTTGKPTVVGYTKNDIDTWADLVARSIRAAGGRPGDMIHVAYGYGLFTGGLGAHYGAERAGCTVIPMSGGQTEKQVQLIQDFKPDIIMVTPSYMQVIIEQFERQGLDAKDSSLKLGIFGAEPWTEAMRRDIETKAGIDAVDIYGLSEVMGPGVASECVESKDGPVIWEDHFYPEIIDPETGALKADGEEGELVFTSLSKEAMPIVRYRTRDLTRLLPPTSRA... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | A0A7L8SJ39 | ['CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)CC4=CC=CC=C4)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[363.62999999999994, 885.676, -0.09259999999999574, 9, 19, 21, 3, 0.5172413793103449, 197.24409999999972, 0], [186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
74 | ligase | Atrazine | MTAIKEQVGRDAIEHASVDEIRNLQLERLKWTLKHAYENVPHYRQKFDEAGVHPDDLKQLSDISKFPFTTKQDLRDNYPFKMFAVPREQVARVHASSGTTGKPTVVGYTANDISTWADLFARSMWAAGARPGDIAHVAYGYGLFTGGLGAHYGAERLGCTVVPMSGGQTEKQVQLIQDFRPDVILVTPSYFCNIVEEIERQGMDPRDTSLRIGIFGAEPWTGQMRLDIEQRAGIDAVDIYGLSEVMGPGVAMECVESKDGPVVWEDHFYPEIINPETGEPVAEGESGELVFTSLSKEAMPVIRYRTRDLTQLLPPTSRSM... | [41.910000000000004, 172.619, 0.8125199999999999, 0, 4, 2, 1, 0.5, 43.68700000000002, 0] | CC1=NC=NC(=N1)N(C)CCl | U7U996 | ['CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)CC4=CC=CC=C4)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[363.62999999999994, 885.676, -0.09259999999999574, 9, 19, 21, 3, 0.5172413793103449, 197.24409999999972, 0], [186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
75 | ligase | Glyphosate | MTSEFLSHLRRELAGLKEAGLFKAERVITSKQAGEIAVLGGARVLNFCANNYLGLADNEELADAAKRALDRYGYGMASVRFICGTQEEHKQLEARISAFLGMEATILYSSCFDANGGLFETLLSEEDAIISDALNHASIIDGVRLSKAKRFRYANNDMAALEEELKKAEGSRFKLIATDGVFSMDGIIANLGGVCDLAEKYGAMVMVDDSHAVGFVGAHGRGSAEYCGVEGRIDIITGTLGKALGGASGGYTSARGEIVEWLRQRSRPYLFSNTLAPVIAAASLKVFDLIENGTELRARLRGNAELFRSEMTKLGFTLAG... | [106.86000000000001, 169.073, -1.2042000000000002, 4, 3, 4, 0, 0.6666666666666666, 32.54959999999999, 0] | C(C(=O)O)NCP(=O)(O)O | A0A7X8SD31 | ['CC(=O)[C@@H](C(=O)O)N', 'CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCS)O'] | [[80.39, 117.104, -1.0126999999999995, 2, 3, 2, 0, 0.5, 26.292199999999998, 0], [346.55999999999995, 767.5410000000002, -1.6652999999999962, 10, 18, 18, 2, 0.6666666666666666, 163.4860999999999, 0]] |
76 | ligase | Glyphosate | MTSAFLSHLTSELASLKDAGLYKSERVITSKQAGEIAVASGERVLNFCANNYLGLADNEELAEAGKKALDRYGYGMASVRFICGTQEEHKELEARISSFLGMEDTILYSSCFDANGGLFETLLGEEDAIISDALNHASIIDGVRLSKAKRFRYANNDMKALEEELKKAEGSRFKMIATDGVFSMDGIIANLQGVCDLAEKYGAMVMVDDSHAVGFVGKNGRGSAEHCGVEGRIDIITGTLGKALGGASGGYTSAKAEVVDWLRQRSRPYLFSNTLAPVIAAASLKVFDLIENGSALREKLSANAALFRSEMTKLGFTLAG... | [106.86000000000001, 169.073, -1.2042000000000002, 4, 3, 4, 0, 0.6666666666666666, 32.54959999999999, 0] | C(C(=O)O)NCP(=O)(O)O | A0A7X8T9K0 | ['CC(=O)[C@@H](C(=O)O)N', 'CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCS)O'] | [[80.39, 117.104, -1.0126999999999995, 2, 3, 2, 0, 0.5, 26.292199999999998, 0], [346.55999999999995, 767.5410000000002, -1.6652999999999962, 10, 18, 18, 2, 0.6666666666666666, 163.4860999999999, 0]] |
77 | ligase | Glyphosate | MTTEFLSHLRSELLGLKEAGLYKAERVITSKQAGEIAVLGGARVLNFCANNYLGLADNEELAEAAKKALDRYGYGMASVRFICGTQEEHKQLEARISNFLGMADTILYSSCFDANGGLFETLLSEEDAIISDALNHASIIDGVRLSKAKRFRYANNDMAALEEELKKAEGCRFKLIATDGVFSMDGIIANLGGVCDLAEKYGAMVMVDDSHAVGFVGKHGRGSPEHCGVEGRIDIITGTLGKALGGASGGYTSAKGEIVDWLRQRSRPYLFSNTLAPVIAAASLKVFDLIENGGELRARLKGNAELFRTEMTKLGFTLAG... | [106.86000000000001, 169.073, -1.2042000000000002, 4, 3, 4, 0, 0.6666666666666666, 32.54959999999999, 0] | C(C(=O)O)NCP(=O)(O)O | A0A7X8Y1A9 | ['CC(=O)[C@@H](C(=O)O)N', 'CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCS)O'] | [[80.39, 117.104, -1.0126999999999995, 2, 3, 2, 0, 0.5, 26.292199999999998, 0], [346.55999999999995, 767.5410000000002, -1.6652999999999962, 10, 18, 18, 2, 0.6666666666666666, 163.4860999999999, 0]] |
78 | ligase | Glyphosate | MFKKILIANRGEIACRVIKTARRMGILTVAVYSDADRDALHVEMADESVHIGPAPAAESYLVADKIIAACKETGAEAVHPGYGFLSERASFCAALEKEGIIFIGPKPKAIEAMGDKIESKKFANAANVSTVPGHLGIIDDADHAERIAAEIGYPVMIKASAGGGGKGMRIAWSKDEVRDGFERARSEAKSSFGDDRIFIEKFVVDPRHIEIQVLADAHGNVVYLGERECSIQRRNQKVVEEAPSPFLDEATRKAMGEQSVALAKAVDYQSAGTVEFIVDRDRNFYFLEMNTRLQVEHPVTELVTGIDLVEQMIRVAAGEK... | [106.86000000000001, 169.073, -1.2042000000000002, 4, 3, 4, 0, 0.6666666666666666, 32.54959999999999, 0] | C(C(=O)O)NCP(=O)(O)O | A0A7X8S7Z0 | ['OP(=O)(O)O', 'C[C@@H](C(=O)O)C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O', 'CC[C@@H](C(=O)O)C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O', 'C1=NC(=C2C(=N1)N(C=N2)[... | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [400.93, 867.6140000000001, -1.6145999999999943, 10, 20, 21, 2, 0.64, 183.89789999999974, 0], [400.93, 881.6410000000002, -1.2244999999999953, 10, 20, 22, 2, 0.6538461538461539, 188.5148999999997, 0], [232.59999999999997, 427.2030000000001, ... |
79 | ligase | Glyphosate | MENLSPRAGELEAIEMASRDEISALQLERMKWSLTHAYENSPFYRKRFDETGVHPLDLKTLPDIAKFPFTTKKDLRDTYPFGMFAVPREKLVRIHASSGTTGKPTVVGYTARDIDTWASLVARSIRASGGRAGDIVHIAYGYGLFTGGLGAHYGAEKLGCTVVPVSGGMTERQVALIQDLKPRIIMVTPSYMLSILDEFRRQGLDPRESSLAVGIFGAEPWTNAMRAEIEHAFDMHAVDIYGLSEVMGPGVASECVESKDGLHIWEDHFYPEIIDPVTGAALPDGEIGELVFTTLTKEGLPVIRYRTRDLTRLLPGTARS... | [106.86000000000001, 169.073, -1.2042000000000002, 4, 3, 4, 0, 0.6666666666666666, 32.54959999999999, 0] | C(C(=O)O)NCP(=O)(O)O | A0A7X8SFT4 | ['CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)CC4=CC=CC=C4)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[363.62999999999994, 885.676, -0.09259999999999574, 9, 19, 21, 3, 0.5172413793103449, 197.24409999999972, 0], [186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
80 | ligase | Glyphosate | MFKKILIANRGEIACRVIKTARRMGILTVAVYSDADRDALHVEMADESVHIGPAPASESYLVADKIIAACKETGAEAVHPGYGFLSERASFCAALEKEGIVFIGPKPKAIEAMGDKIESKKFANAAKVSTVPGHLGIIDDADHAEQIAGEIGYPVMIKASAGGGGKGMRIAWSKDEVRDGFERARSEAKSSFGDDRVFIEKFVVDPRHIEIQVLADAHGNVVYLGERECSIQRRNQKVVEEAPSPFLDEATRKAMGEQSVALAKAVDYQSAGTVEFIVDRDRNFYFLEMNTRLQVEHPVTELVTGIDLVEQMIRVAANEK... | [106.86000000000001, 169.073, -1.2042000000000002, 4, 3, 4, 0, 0.6666666666666666, 32.54959999999999, 0] | C(C(=O)O)NCP(=O)(O)O | A0A7X8Y0Q6 | ['OP(=O)(O)O', 'C[C@@H](C(=O)O)C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O', 'CC[C@@H](C(=O)O)C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O', 'C1=NC(=C2C(=N1)N(C=N2)[... | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [400.93, 867.6140000000001, -1.6145999999999943, 10, 20, 21, 2, 0.64, 183.89789999999974, 0], [400.93, 881.6410000000002, -1.2244999999999953, 10, 20, 22, 2, 0.6538461538461539, 188.5148999999997, 0], [232.59999999999997, 427.2030000000001, ... |
81 | ligase | Glyphosate | MFKKILIANRGEIACRVIKTARRMGISTVAVYSDADRDALHVEMADEAVHIGPAAATESYLVADKIIAACKETGAEAVHPGYGFLSERASFCEALEKQGIVFIGPKPKAIKAMGDKIESKKFANAANVSTVPGYLGVIEDAGHAEKIAAEIGYPVMIKASAGGGGKGMRIAWNQAEVRDGFDRARSEAKSSFGDDRVFIEKYIVDPRHIEIQVLADAHGNAVYLGERECSIQRRNQKVAEEAPSPFLDEKTRKAMGEQSIALAKAVDYQSAGTVEFIVDRDRNFYFLEMNTRLQVEHPVTELVTGIDLVEQMIRVAAGET... | [106.86000000000001, 169.073, -1.2042000000000002, 4, 3, 4, 0, 0.6666666666666666, 32.54959999999999, 0] | C(C(=O)O)NCP(=O)(O)O | A0A7X8Y9M1 | ['OP(=O)(O)O', 'C[C@@H](C(=O)O)C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O', 'CC[C@@H](C(=O)O)C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O', 'C1=NC(=C2C(=N1)N(C=N2)[... | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [400.93, 867.6140000000001, -1.6145999999999943, 10, 20, 21, 2, 0.64, 183.89789999999974, 0], [400.93, 881.6410000000002, -1.2244999999999953, 10, 20, 22, 2, 0.6538461538461539, 188.5148999999997, 0], [232.59999999999997, 427.2030000000001, ... |
82 | ligase | Phenol | MSTPIQILNNAAEAVAWLRSRVQGDLQTDSRKVKAGDAFVAWPGAATDGRAYVGKALEQGAAAVLVEAEGLQAFDLSGDRIAALKDLKAATGLIADQWFAHPSGELDVLAVTGTNGKTTTAWWLAHALSKVTLNTRTGCALVGTLGVGVPPALESTGMTTPDPVLLQRAFRSYADQGLAACAIEASSIGIVEHRLDGSKIRVALFTNFTQDHLDYHGSMDAYWQAKAQLFDWPGLPAAVVNIDDAHGARLWARLQGRAMDVWSVSIQGPARLQAKDIGLGDEGLSFTVLEAGHSLRMNTRLVGQYNVSNLLGVLAALRCL... | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A1Y1J129 | ['OP(=O)(O)O', 'C[C@@H](C(=O)N[C@H](CCC(=O)N[C@@H](CCC[C@H](C(=O)O)N)C(=O)O)C(=O)O)NC(=O)[C@@H](C)O[C@@H]1[C@H]([C@H](O[C@@H]([C@H]1O)CO)OP(=O)(O)OP(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=CC(=O)NC3=O)O)O)NC(=O)C\nC[C@H](C(=O)NC(CCC(=O)N[C@@H](CCC[C@H](C(=O)O)N)C(=O)O)C(=O)O)NC(=O)[C@@H](C)O[C@@H]1[C@H]([C@H](O[C@@H](... | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [520.0800000000002, 1051.7960000000003, -6.231200000000003, 15, 23, 27, 1, 0.6857142857142857, 224.1460999999996, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0]] |
83 | ligase | Phenol | MPKRNDLKSILIIGAGPIVIGQACEFDYSGVQACKALREEGYKVILINSNPATIMTDPATADVTYIEPITWQTVEKIIAKERPDAILPTMGGQTALNCALDLWKNGVLDKYKVELIGAKPEAIDKAEDRLKFKDAMTKIGLGSARSGIAHSMDEAWAVQKQMGFPTVIRPSFTLGGTGGGIAYNPEEFETICKRGLEASPTNELLIEESLLGWKEYEMEVVRDTADNCIIVCSIENLDPMGVHTGDSITVAPAQTLTDKEYQIMRNASLAVLREIGVDTGGSNVQFSVNPKDGRMIVIEMNPRVSRSSALASKATGFPIA... | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A1Y1J2M1 | ['C(=O)(N)OP(=O)(O)O', 'C(CC(=O)O)[C@@H](C(=O)O)N', 'OP(=O)(O)O', 'N', 'C(=O)(N)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N', 'C(=O)(O)OP(=O)(O)O'] | [[109.85000000000002, 141.019, -0.8255999999999999, 3, 3, 1, 0, 0.0, 22.7125, 0], [100.61999999999999, 147.13, -0.736899999999999, 3, 3, 4, 0, 0.6, 32.480999999999995, 0], [77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [35.0, 17.031, 0.16199999999999998, 1, 1, 0, 0, 0.0, 5.0221, 0], [63.3... |
84 | ligase | Phenol | MTKFVFVTGGVVSSLGKGIASASLAAILESRGLKVTLIKLDPYINVDPGTMSPFQHGEVFVTDDGAETDLDLGHYERFIETRMRQSNNFTTGRIYQSVLEKERRGDYLGKTVQVIPHVTNEIQEYIKRGAGLGTDHEVDVAICEVGGTVGDIESLPFLEAARQLALKLGPNNSAFVHLTYLPFIETAGELKTKPTQHTVQKLREIGIQPDALLCRAKHQVPEEEKSKISLFTNVPEWGVISMWDVDTIYKVPRMLHEQGLDGLICDKLRLNTPPTNLKRWDDLVYETEHPQGEVKIAMVGKYVELSDAYKSVNEALKHAG... | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A1Y1J5D5 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N', 'OP(=O)(O)O', 'N', 'C(CC(=O)O)[C@@H](C(=O)O)N', 'C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O'] | [[232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0], [77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [35.0, 17.031, 0.16199999999999998, 1, 1, 0, 0, 0.0, 5.0221, 0], [100.61999999999999, 147.13, -0.736899999999999, 3, 3, 4, 0, 0.6, 32.480999999999995... |
85 | ligase | Phenol | MHTIFPTLDAWLAYCERLHPQNIALGLDRVREVAQRMGLQFDCPVITVAGTNGKGSTCAMLEAVALQSGFRPGVYTSPHLVHFEERCRVGGEIVKAEELIPHFEAVEQARVKDGKEVALTYFEFTTLAILRLMSLSRLDVAILEVGLGGRLDATNIIDADCAIITSIDLDHMELLGPDRESIGREKAGIMRAGRPVIVSDPVPPQSVIDHAAEIGADLWRFGKDFNYDGDKQQWGWAGRGRRYAGLAYPALRGANQLMNASGVLAAYEAIRGKLPVTAQAVRTGLSMVELPGRFQIVPGQPTLVLDVAHNPHSVAALTAN... | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A1Y1J8Q2 | ['C1[C@@H](NC2=C(N1)N=C(NC2=O)N)CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O', 'C1[C@@H](NC2=C(N1)N=C(NC2=O)N)CN(C=O)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N', 'C1[C@@H](NC2... | [[277.96, 574.5510000000004, -0.9323999999999946, 10, 11, 14, 2, 0.375, 144.66249999999997, 0], [352.64, 731.6760000000004, -2.0318999999999905, 11, 13, 20, 2, 0.4, 178.38329999999985, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0], [286.23999999999995, 602.5610000000005,... |
86 | ligase | Phenol | MPKRTDIKSILIIGAGPIIIGQACEFDYSGAQACKALREEGFKVILVNSNPATIMTDPNTADVTYIEPITWEVVERIIAKERPDAILPTMGGQTALNCALDLHRHGVLDKYKVELIGASPEAIDKAEDRQKFKDAMTRIGLGSAKSGIAHSMDEAVAVQGRIAQETGTAGYPIVIRPSFTLGGTGGGIAYNREEFEEICKRGLDLSPTRELLIEESLLGWKEYEMEVVRDKQDNCIIICSIENLDPMGIHTGDSITVAPAQTLTDKEYQILRNASLAVLREIGVDTGGSNVQFSINPKDGRMIVIEMNPRVSRSSALASK... | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A375G4R2 | ['C(=O)(N)OP(=O)(O)O', 'C(CC(=O)O)[C@@H](C(=O)O)N', 'OP(=O)(O)O', 'N', 'C(=O)(N)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N', 'C(=O)(O)OP(=O)(O)O'] | [[109.85000000000002, 141.019, -0.8255999999999999, 3, 3, 1, 0, 0.0, 22.7125, 0], [100.61999999999999, 147.13, -0.736899999999999, 3, 3, 4, 0, 0.6, 32.480999999999995, 0], [77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [35.0, 17.031, 0.16199999999999998, 1, 1, 0, 0, 0.0, 5.0221, 0], [63.3... |
87 | ligase | Phenol | MTKFVFVTGGVVSSLGKGIAAASLAAILESRGLKVTLLKLDPYINVDPGTMSPFQHGEVFVTEDGAETDLDLGHYERFVSAKMRKSNNFTTGQIYESVIRKERRGEYLGKTVQVIPHITNEIQAFIEKGAAASHDGKADVALVEIGGTVGDIESLPFLEAARQMSLRMGRNHAAFVHLTLVPFIASAGELKTKPTQHSVQKLREIGISPTALLCRADRPIPDDERAKISLFANIPQDAVISVWDADSIYKIPQMLNEQGLDRLICEELRLDPRPADLSMWQKLVNAQENPEHEITIGMVGKYVDLTESYKSLIEALRHAG... | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A5P3VL77 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N', 'OP(=O)(O)O', 'N', 'C(CC(=O)O)[C@@H](C(=O)O)N', 'C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O'] | [[232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0], [77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [35.0, 17.031, 0.16199999999999998, 1, 1, 0, 0, 0.0, 5.0221, 0], [100.61999999999999, 147.13, -0.736899999999999, 3, 3, 4, 0, 0.6, 32.480999999999995... |
88 | ligase | Phenol | MPVFHTLPEWLAHLETAHPVGIDMGLTRITRVKEALGLRIDATVFTVGGTNGKGSTCAMLERILLEAGYKVGCHTSPHLISFNERARLNGEMATDAQLLPHFEAVERARNSFADPVSLTYFEFTTLAIIHFFAASGLDAIILEVGLGGRLDATNVIDTDCAIVTSIDIDHTQYLGNTREEIGFEKAGIFRPGVPAVCGDPMPPKSLVAHAEAIGAELWLVGRDFHFHAAKGQERQQWDWSGGGRKLNGLGYPALRGANQLLNAAAVLAALQAMRPQLPVSAQEVRNGLAFVELPGRFQVLPGRPAVILDVAHNPHAAATL... | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A5P3VLH8 | ['C1[C@@H](NC2=C(N1)N=C(NC2=O)N)CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O', 'C1[C@@H](NC2=C(N1)N=C(NC2=O)N)CN(C=O)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N', 'C1[C@@H](NC2... | [[277.96, 574.5510000000004, -0.9323999999999946, 10, 11, 14, 2, 0.375, 144.66249999999997, 0], [352.64, 731.6760000000004, -2.0318999999999905, 11, 13, 20, 2, 0.4, 178.38329999999985, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0], [286.23999999999995, 602.5610000000005,... |
89 | ligase | Phenol | MTAKPLLPLEVTTQASNALAWLRTNVAASAQLTGDSRRLARGDVFLAYVLGNERLASDGRPYIQQAIAAGAGAIVYEAEGFDWPFGDAVPHLAVGNLHQLAGPIAAGWHGNPVRGLAVTGITGTNGKTSCSQWLARVLQAAGTPCATVGTLGTGFPGALQATGFTTPDAVQLQASLAALHDAGARAVTMEVSSHGLEQERVAGTHFSVAVLTNLTQDHLDYHGSMNEYEAAKERLFQWDGLRTAVINRDDAMGQRLLAADAAAIAAPHVIEYGIDGPGAATVRRPRGEWLRATSVRATPNGTAFHIDGSFGSAEMATPMI... | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A5P3VRG4 | ['OP(=O)(O)O', 'C[C@@H](C(=O)N[C@H](CCC(=O)N[C@@H](CCC[C@H](C(=O)O)N)C(=O)O)C(=O)O)NC(=O)[C@@H](C)O[C@@H]1[C@H]([C@H](O[C@@H]([C@H]1O)CO)OP(=O)(O)OP(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=CC(=O)NC3=O)O)O)NC(=O)C\nC[C@H](C(=O)NC(CCC(=O)N[C@@H](CCC[C@H](C(=O)O)N)C(=O)O)C(=O)O)NC(=O)[C@@H](C)O[C@@H]1[C@H]([C@H](O[C@@H](... | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [520.0800000000002, 1051.7960000000003, -6.231200000000003, 15, 23, 27, 1, 0.6857142857142857, 224.1460999999996, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0]] |
90 | ligase | Phenol | MSIFINKDTKVITQGITGKTGQFHTEKCQEYANGKNCFVAGVNPKKAGEKIFDIPIFGSVKDAAKETGATVSVIYVPPAGAAAAIWEAVEADLDLAICITEGIPVRDMLEVRNKMKAKEAAGGKKTLLLGPNCPGLITPDEIKIGIMPGHIHKKGRVGVVSRSGTLTYEAVAQLSELGIGQSSAVGIGGDPINGLKHIDVMRAFNDDPDTDAVIMIGEIGGPDEAEAAQWCKANMKKPIVGFIAGVTAPPGKRMGHAGALISGGADTADAKLAIMEECGFTITRNPSEMGRLLQGLLKK | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A096F7C0 | ['OP(=O)(O)O', 'CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)CCC(=O)O)O', 'CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)CC(=C)C(=O)O)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([... | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [400.92999999999995, 867.614, -1.4704999999999948, 10, 20, 22, 2, 0.64, 183.9678999999998, 0], [400.92999999999995, 879.625, -1.3043999999999958, 10, 20, 22, 2, 0.5769230769230769, 188.4908999999998, 0], [232.59999999999997, 427.203000000000... |
91 | ligase | Phenol | MKIHEYQGKEILRQFGVPVPRGIPAFTVQEAVEAAQKLGGPVWVVKAQIHAGGRGKGGGVKVAKSIEDVQKLSEQILGMQLVTHQTGPEGQKVRRLYIEDGADIKNELYVSLVTDRATQKVALIASSEGGMDIEEVAHSTPEKIITEMIDPLTGITEAQSRKVAAAIGLEGKSVDQAVDLFAKIYKCYMDTDASLVEINPLNCDSKGDLMALDAKFNFDPNALFRHPEIVAFRDLDEEDAAEIEASKFDLAYISLDGNIGCLVNGAGLAMATMDTIKLFGGEPANFLDVGGGATAEKVTEAFKIMLKNPEVKGILVNIFG... | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A096GL28 | ['OP(=O)(O)O', 'CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)CCC(=O)O)O', 'CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)CC(=C)C(=O)O)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([... | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [400.92999999999995, 867.614, -1.4704999999999948, 10, 20, 22, 2, 0.64, 183.9678999999998, 0], [400.92999999999995, 879.625, -1.3043999999999958, 10, 20, 22, 2, 0.5769230769230769, 188.4908999999998, 0], [232.59999999999997, 427.203000000000... |
92 | ligase | Phenol | MSEARQILVTSALPYANGSIHLGHMLEYIQTDMWVRFQKLRGNQCIYVCADDAHGSAIMLRAEKEGITPEQLIANVQAEHGSDFADFLVDFDNFHSTHSEENRKLAELIYTRLRDAGHIATRSVTQYFDPEKGMFLADRFIKGTCPKCAAEDQYGDNCEKCGATYEPTELKDPRSAISGATPVLKDSKHFFFKLPDFEAMLKQWTRGGALQESVANKIAEWLDGGLQEWDISRDAPYFGFEIPGEPSKYFYVWLDAPIGYMASFENLCKRRPELSFDTFWSKDSTAELYHFIGKDIINFHTLFWPAMLEGAGFRKPTAVN... | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A0S2UP27 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
93 | ligase | Phenol | MSMFGTNIDVKALGKVAVLMGGRSSEREVSLMSGTGVLAALQSKGVDAHKFDPAEQGLDQLKVQGFDRCFIALHGRYGEDGTVQGALELLDIPYTGSGVMASSIAMDKIMTKRIWRFEGLPTPDWRMVDSAEATRDALQALGAPMIVKPARDGSSIGLTKVMNADECAKAYELAAQYDAEVLCEQFIAGDETTCPVLGTGAKAAALPVIRIVAPEGNYDYQNKYFTDTTQYHCPSGLPAAEEAEIQRIVEKAFRTLGCRGWARADIMIRASDRKPFLLEINTSPGMTGHSLVPMAARASGVSYENLCLGILAMSTLDGEA... | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A1Y1IUC6 | ['OP(=O)(O)O', 'C[C@H](C(=O)N[C@H](C)C(=O)O)N', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [92.42, 160.17299999999997, -1.0770999999999993, 3, 3, 3, 0, 0.6666666666666666, 38.8899, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0]] |
94 | ligase | Phenol | MQIVHTIADLRAALAGRGRPAFVPTMGNLHEGHLSLVRQARQHGDVTVASIFVNRLQFLPHEDFDSYPRTFDADCAKLEAEGCDIVFAPREKDLYPEPQTFKVLPDAQLADILEGHFRPGFFTGVCTVVMKLFQAVFATTGGGTAVFGQKDYQQLMVIRRMVQQFALPIEIIGCATARANSGLALSSRNGYLSDEQRVQAMALSQALKALADAARQGGNLADLETQAMAALRAKGWEPDYLSVRQRSDLQTPVDARSGELVALGAARLGSTRLIDNLEF | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A1Y1IVH2 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'CC(C)(CO)[C@H](C(=O)NCCC(=O)O)O', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [106.86000000000001, 219.23699999999997, -1.0432999999999986, 4, 4, 6, 0, 0.7777777777777778, 52.13610000000003, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
95 | ligase | Phenol | MNTSKGRNVVVVGTQWGDEGKGKLVDWLTESANGVVRFQGGHNAGHTLVINGVKTALHLIPSGIMRPGVKCYIGNGVVLSVGKLFEEIEGLEKAGVQVRERLRVSEACPLILPFHQALDVAREAAREKGGVQKIGTTGKGIGPSYEDKIARRALRVQDLKHPERFATKLRELLNLHNHILVNVLGSKNFDFGAGLAPYMKDGEVQFDAVYEEAMRHAELLKPMIADVSRELNAVHAEGGNLLFEGAQGTLLDVDHGTYPYVTSSNCVAGNAAAGAGVGPGLLHYILGITKAYCTRVGGGPFPTELEWEKEGTPGWVMSTV... | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A1Y1IXD5 | ['OP(=O)(O)O', 'C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N=C(NC2=O)N', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N[C@@H](CC(=O)O)C(=O)O'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [252.57, 443.20200000000006, -2.452699999999999, 7, 12, 6, 2, 0.5, 87.3911, 0], [246.67999999999995, 463.29600000000016, -2.1053999999999986, 7, 12, 9, 2, 0.5, 96.54200000000004, 0]] |
96 | ligase | Phenol | MQDATMTTLGTPLSPNATKVMLLGSGELGKEVLIALQRLGVETIAVDRYENAPGQQVAHHARTITMSDPAQLKALIEEVKPDLVVPEIEAIATPMLEELEAAGVITCIPTARAARLTMDREGIRRLAAETLGLPTSPYRFCDSLVELQAAIDGSDGQPAIGYPCVVKPVMSSSGKGQSKIDGPADVAKAWDYAMAGGRVAKGRVIVEGFIDFDYEITQLTVRAKGADGQIETHFCDPVGHIQQAGDYVESWQPHPMHPAALEKSRQIAKAVTDDLGGLGLFGVELFVKGEQVWFSEVSPRPHDTGLVTLCTQWQSEFELH... | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A1Y1J3T5 | ['OP(=O)(O)O', 'C([C@@H]1[C@H]([C@H]([C@@H](O1)NC(=O)CNC=O)O)O)OP(=O)(O)O', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [174.65, 314.187, -3.595399999999998, 6, 7, 7, 0, 0.75, 60.88010000000003, 0], [232.59999999999997, 427.2030000000001, -1.7460000000000004, 6, 12, 6, 2, 0.5, 84.5654, 0]] |
97 | ligase | Phenol | MTEQNISSAAENTAPQDENKLIAERREKLKALRESSKANGGVAFPNDFKPEHRAAALIAEHSDKDAEALDAAAVAVSVAGRMMLKRVMGKASFATVQDATGRIQAYVTRDAVGEEVYADFKKWDLGDIISVEGQLMKTKTGELSIKATKIRLLTKSLRPMPDKFHGMADLEQKVRQRYVDLMTDEEARKRFVARSKAVAGIRDFMVEHGFLEVETPMLHPIPGGANAKPFITHHNALDQEMYLRIAPELYLKRLIVGGFERVFEINRNFRNEGISVRHNPEFTMMEFYAAYWNYQDLMDYTEKLIRDAAIKAVGTLELSY... | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A1Y1J473 | ['C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N', 'OP(=O)(O)OP(=O)(O)O'] | [[186.07, 347.22400000000005, -1.863, 5, 10, 4, 2, 0.5, 73.65509999999999, 0], [124.29000000000002, 177.973, -0.8116000000000001, 4, 3, 2, 0, 0.0, 25.173199999999998, 0]] |
98 | ligase | Phenol | MSWLEKLLPAKIQQTNPTERHQQIPEGLWIKCPSCETVLYKTDLEKNQNVCPTCGHHHRIGARARLNHFLDAEGRYELAQEVIPVDPLKFKDSRKYPERLKEALENTGETDALIVMGGSVKSINVVVACFEFDFMGGSMGSVVGERFVRGVETAIEQKVPFICFTATGGARMQEGLLSLMQMAKTNAALTRLAKKGLPYISVLTDPTMGGVSAGFAFVGDIVIAEPKALIGFAGPRVIETTVRVKLPEGFQRAEFLQDKGAVDMIVDRRELRDRISSSLAMLQRLPADAVE | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A1Y1J7B8 | ['CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)CC(=O)O)O'] | [[400.92999999999995, 853.5870000000001, -1.8605999999999934, 10, 20, 21, 2, 0.625, 179.35089999999983, 0]] |
99 | ligase | Phenol | MQITRNRALRGPNLWTRSTAIEAIVHCEDSELLYTAMPGFEEKLRARFPTIGTLQPHGADQRLSLAHVLEVAALSLQAQAGCPVTFSRTHETVEHGTFQVVVEYTEESVGKLAMERAEALIQAALNDTPFDADATIAELRELDEDDRIGPSTGAIVDAAVARGIPFRRLTTGSLVQLGWGSRARRFQAAEIDSTSAVAESIAQDKDLTKRLLHAAGVPVPMGRPVTDVEDAWAVALEVGLPVVVKPQDGNQGKGVVVNITTREGLEAAYKTASEFGDEILVERFLPGHDFRMLVVGGQLVAAARREPPQVLGDGQHTIRE... | [20.23, 94.11299999999999, 1.3922, 1, 1, 0, 1, 0.0, 28.106799999999993, 0] | c1ccccc1O | A0A1Y1J9Y9 | ['OP(=O)(O)O', 'C(C[C@@H](C(=O)O)NC(=O)CC(C(=O)NC(CC(=O)O)C(=O)O)N)CN=C(N)N', 'C(C[C@@H](C(=O)O)NC(=O)CC(C(=O)NC(CC(=O)N[C@@H](CCCN=C(N)N)C(=O)O)C(=O)O)N)CN=C(N)N', 'C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N'] | [[77.76, 97.99399999999999, -0.9286000000000001, 3, 1, 0, 0, 0.0, 14.2629, 0], [260.52, 404.38000000000017, -3.6290999999999976, 8, 7, 13, 0, 0.5714285714285714, 93.88900000000002, 0], [354.0199999999999, 560.5690000000001, -5.090700000000011, 11, 9, 19, 0, 0.6, 135.73050000000012, 0], [232.59999999999997, 427.20300000... |
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