Reaction Details |
| Report a problem with these data |
Target | 3-oxoacyl-[acyl-carrier-protein] synthase 1 |
---|
Ligand | BDBM50241313 |
---|
Substrate/Competitor | n/a |
---|
Meas. Tech. | ChEMBL_330089 (CHEMBL863311) |
---|
IC50 | 12000±n/a nM |
---|
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 Chem49:159-71 (2006) [PubMed] Article |
---|
More Info.: | Get all data from this article, Assay Method |
---|
|
3-oxoacyl-[acyl-carrier-protein] synthase 1 |
---|
Name: | 3-oxoacyl-[acyl-carrier-protein] synthase 1 |
Synonyms: | FABB_ECOLI | fabB | fabC |
Type: | PROTEIN |
Mol. Mass.: | 42605.82 |
Organism: | Escherichia coli (strain K12) |
Description: | ChEMBL_330089 |
Residue: | 406 |
Sequence: | MKRAVITGLGIVSSIGNNQQEVLASLREGRSGITFSQELKDSGMRSHVWGNVKLDTTGLI
DRKVVRFMSDASIYAFLSMEQAIADAGLSPEAYQNNPRVGLIAGSGGGSPRFQVFGADAM
RGPRGLKAVGPYVVTKAMASGVSACLATPFKIHGVNYSISSACATSAHCIGNAVEQIQLG
KQDIVFAGGGEELCWEMACEFDAMGALSTKYNDTPEKASRTYDAHRDGFVIAGGGGMVVV
EELEHALARGAHIYAEIVGYGATSDGADMVAPSGEGAVRCMKMAMHGVDTPIDYLNSHGT
STPVGDVKELAAIREVFGDKSPAISATKAMTGHSLGAAGVQEAIYSLLMLEHGFIAPSIN
IEELDEQAAGLNIVTETTDRELTTVMSNSFGFGGTNATLVMRKLKD
|
|
|
BDBM50241313 |
---|
n/a |
---|
Name | BDBM50241313 |
Synonyms: | (5R)-4-hydroxy-3,5-dimethyl-5-[(1E)-2-methylbuta-1,3-dienyl]thiophen-2(5H)-one | (R)-(+)-Thiolactomycin | (R)-4-Hydroxy-3,5-dimethyl-5-((E)-2-methyl-buta-1,3-dienyl)-5H-thiophen-2-one | (R,E)-4-hydroxy-3,5-dimethyl-5-(2-methylbuta-1,3-dienyl)thiophen-2(5H)-one | 5R-Thiolactomycin | CHEMBL399043 | TLM analog, 1 |
Type | Small organic molecule |
Emp. Form. | C11H14O2S |
Mol. Mass. | 210.293 |
SMILES | CC1C(=O)S[C@](C)(\C=C(/C)C=C)C1=O |r| |
Structure |
|