Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
Target3-oxoacyl-[acyl-carrier-protein] synthase 3
LigandBDBM50134348
Substrate/Competitorn/a
Meas. Tech.ChEBML_37595
IC50 19000±n/a nM
Citation Senior, SJIllarionov, PAGurcha, SSCampbell, IBSchaeffer, MLMinnikin, DEBesra, GS Biphenyl-based analogues of thiolactomycin, active against Mycobacterium tuberculosis mtFabH fatty acid condensing enzyme. Bioorg Med Chem Lett13:3685-8 (2003) [PubMed]
More Info.:Get all data from this article,  Assay Method
 
3-oxoacyl-[acyl-carrier-protein] synthase 3
Name:3-oxoacyl-[acyl-carrier-protein] synthase 3
Synonyms:β-Ketoacyl-acyl carrier protein (ACP) synthase III (FabH) | 3-oxoacyl-[acyl-carrier-protein] synthase III | FABH_MYCTU | fabH
Type:Enzyme
Mol. Mass.:34865.07
Organism:Mycobacterium tuberculosis
Description:P9WNG3
Residue:335
Sequence:
MTEIATTSGARSVGLLSVGAYRPERVVTNDEICQHIDSSDEWIYTRTGIKTRRFAADDES
AASMATEACRRALSNAGLSAADIDGVIVTTNTHFLQTPPAAPMVAASLGAKGILGFDLSA
GCAGFGYALGAAADMIRGGGAATMLVVGTEKLSPTIDMYDRGNCFIFADGAAAVVVGETP
FQGIGPTVAGSDGEQADAIRQDIDWITFAQNPSGPRPFVRLEGPAVFRWAAFKMGDVGRR
AMDAAGVRPDQIDVFVPHQANSRINELLVKNLQLRPDAVVANDIEHTGNTSAASIPLAMA
ELLTTGAAKPGDLALLIGYGAGLSYAAQVVRMPKG
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50134348
n/a
NameBDBM50134348
Synonyms:4-Hydroxy-5-(4'-hydroxymethyl-biphenyl-4-ylmethyl)-3,5-dimethyl-5H-thiophen-2-one | CHEMBL122848
TypeSmall organic molecule
Emp. Form.C20H20O3S
Mol. Mass.340.436
SMILESCC1C(=O)SC(C)(Cc2ccc(cc2)-c2ccc(CO)cc2)C1=O
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: