| Reaction Details |
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 | Report a problem with these data |
| Target | β-Ketoacyl-acyl carrier protein (ACP) synthase III (FabH) |
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| Ligand | BDBM50180134 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_330093 |
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| IC50 | >100000±n/a nM |
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| Citation |  Kim P; Zhang YM; Shenoy G; Nguyen QA; Boshoff HI; Manjunatha UH; Goodwin MB; Lonsdale J; Price AC; Miller DJ; Duncan K; White SW; Rock CO; Barry CE; Dowd CS Structure-activity relationships at the 5-position of thiolactomycin: an intact (5R)-isoprene unit is required for activity against the condensing enzymes from Mycobacterium tuberculosis and Escherichia coli. J Med Chem 49:159-71 (2006) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| β-Ketoacyl-acyl carrier protein (ACP) synthase III (FabH) |
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| Name: | 3-oxoacyl-[acyl-carrier-protein] synthase III |
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| Synonyms: | 3-oxoacyl-[acyl-carrier-protein] synthase III |
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| Type: | Enzyme |
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| Mol. Mass.: | 34865.07 |
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| Organism: | Mycobacterium tuberculosis |
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| Description: | P9WNG3 |
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| Residue: | 335 |
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| Sequence: | MTEIATTSGARSVGLLSVGAYRPERVVTNDEICQHIDSSDEWIYTRTGIKTRRFAADDES
AASMATEACRRALSNAGLSAADIDGVIVTTNTHFLQTPPAAPMVAASLGAKGILGFDLSA
GCAGFGYALGAAADMIRGGGAATMLVVGTEKLSPTIDMYDRGNCFIFADGAAAVVVGETP
FQGIGPTVAGSDGEQADAIRQDIDWITFAQNPSGPRPFVRLEGPAVFRWAAFKMGDVGRR
AMDAAGVRPDQIDVFVPHQANSRINELLVKNLQLRPDAVVANDIEHTGNTSAASIPLAMA
ELLTTGAAKPGDLALLIGYGAGLSYAAQVVRMPKG
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| BDBM50180134 |
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| n/a |
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| Name | BDBM50180134 |
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| Synonyms: | 3,5-dimethyl-5-(hex-5-enyl)-4-hydroxy-5H-thiophen-2-one | CHEMBL200852 |
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| Type | Small organic molecule |
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| Emp. Form. | C12H18O2S |
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| Mol. Mass. | 226.335 |
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| SMILES | CC1C(=O)SC(C)(CCCCC=C)C1=O |
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| Structure | 
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