| Reaction Details |
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 | Report a problem with these data |
| Target | 3-oxoacyl-ACP synthase |
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| Ligand | BDBM50079706 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1472518 (CHEMBL3421140) |
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| IC50 | 7500±n/a nM |
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| Citation |  Sahner, JH; Empting, M; Kamal, A; Weidel, E; Groh, M; Börger, C; Hartmann, RW Exploring the chemical space of ureidothiophene-2-carboxylic acids as inhibitors of the quorum sensing enzyme PqsD from Pseudomonas aeruginosa. Eur J Med Chem96:14-21 (2015) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| 3-oxoacyl-ACP synthase |
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| Name: | 3-oxoacyl-ACP synthase |
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| Synonyms: | 2-heptyl-4(1H)-quinolone synthase PqsD | 3-oxoacyl-(Acyl carrier protein) synthase III | 3-oxoacyl-ACP synthase | ERS445055_04170 | PA8380_44470 | PAE221_04722 | PQB biosynthetic 3-oxoacyl-[acyl-carrier-protein] synthase III | YQ19_24710 | pqsD |
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| Type: | PROTEIN |
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| Mol. Mass.: | 36357.84 |
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| Organism: | Pseudomonas aeruginosa |
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| Description: | ChEMBL_109728 |
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| Residue: | 337 |
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| Sequence: | MGNPILAGLGFSLPKRQVSNHDLVGRINTSDEFIVERTGVRTRYHVEPEQAVSALMVPAA
RQAIEAAGLLPEDIDLLLVNTLSPDHHDPSQACLIQPLLGLRHIPVLDIRAQCSGLLYGL
QMARGQILAGLARHVLVVCGEVLSKRMDCSDRGRNLSILLGDGAGAVVVSAGESLDDGLL
DLRLGADGNYFDLLMTAAPGSASPTFLDENVLREGGGEFLMRGRPMFEHASQTLVRIAGE
MLAAHELTLDDIDHVICHQPNLRILDAVQEQLGIPQHKFAVTVDRLGNMASASTPVTLAM
FWPDIQPGQRVLVLTYGSGATWGAALYRKPEEVNRPC
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| BDBM50079706 |
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| n/a |
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| Name | BDBM50079706 |
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| Synonyms: | CHEMBL3414799 |
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| Type | Small organic molecule |
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| Emp. Form. | C23H22N2O6S |
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| Mol. Mass. | 454.496 |
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| SMILES | COc1ccc(-c2cc(NC(=O)N[C@@H](Cc3ccccc3)C(O)=O)c(s2)C(O)=O)c(C)c1 |r| |
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| Structure | 
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