| Reaction Details |
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 | Report a problem with these data |
| Target | GNAT family acetyltransferase |
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| Ligand | BDBM50193482 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_385423 (CHEMBL869194) |
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| Ki | 110±n/a nM |
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| Citation |  Gao, F; Yan, X; Shakya, T; Baettig, OM; Ait-Mohand-Brunet, S; Berghuis, AM; Wright, GD; Auclair, K Synthesis and structure-activity relationships of truncated bisubstrate inhibitors of aminoglycoside 6'-N-acetyltransferases. J Med Chem49:5273-81 (2006) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| GNAT family acetyltransferase |
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| Name: | GNAT family acetyltransferase |
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| Synonyms: | Aminoglycoside acetyltransferase |
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| Type: | PROTEIN |
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| Mol. Mass.: | 21017.80 |
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| Organism: | Enterococcus durans |
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| Description: | ChEMBL_385423 |
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| Residue: | 183 |
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| Sequence: | MIISEFDRDNLVLRDQLADLLRLTWPDEYGEQPMKEVERLLEDERIAVSAIEGDELIGFV
GAIPQYGQTGWELHPLVVESMYRKQQVGTRLVSYLEKEIASQGGIVVYLGTDDVEGQTSL
AIEEDLFEDTFDKLETIQNRKDHPYEFYEKLGYQIVGVIPDANGWNKPDIWMAKRIARKH
GSE
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| BDBM50193482 |
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| n/a |
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| Name | BDBM50193482 |
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| Synonyms: | CID44414946 | [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonatooxy)oxolan-2-yl]methyl {[(3R)-3-({2-[(2-{[({[(2R,3S,4S,5R,6R)-6-{[(1R,2R,3S,4R,6S)-4,6-diamino-3-{[(2S,3R,4S,5S,6R)-4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-hydroxycyclohexyl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl}carbamoyl)methyl]sulfanyl}ethyl)carbamoyl]ethyl}carbamoyl)-3-hydroxy-2,2-dimethylpropyl phosphonato]oxy}phosphonate | truncated aminoglycoside-coenzyme A bisubstrate analogue 2 |
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| Type | Small organic molecule |
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| Emp. Form. | C41H68N11O28P3S |
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| Mol. Mass. | 1288.024 |
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| SMILES | CC(C)(COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP([O-])([O-])=O)n1cnc2c(N)ncnc12)[C@@H](O)C(=O)NCCC(=O)NCCSCC(=O)NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O |
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| Structure | 
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