Reaction Details Report a problem with these data
Target
UDP-N-acetylglucosamine 1-carboxyvinyltransferase
Ligand
BDBM50370832
Substrate
n/a
Meas. Tech.
ChEMBL_424366 (CHEMBL911297)
IC50
10300±n/a nM
Citation
 Bachelier, A; Mayer, R; Klein, CD Sesquiterpene lactones are potent and irreversible inhibitors of the antibacterial target enzyme MurA. Bioorg Med Chem Lett 16:5605-9 (2006) [PubMed]  Article 
Target
Name:
UDP-N-acetylglucosamine 1-carboxyvinyltransferase
Synonyms:
EPT | Enoylpyruvate transferase | MURA_PSEAE | MurA (P. aeruginosa) | UDP-N-acetylglucosamine 1-carboxyvinyltransferase | UDP-N-acetylglucosamine enolpyruvyl transferase | murA
Type:
Protein
Mol. Mass.:
44640.67
Organism:
Pseudomonas aeruginosa (G-proteobacteria)
Description:
P. aeruginosa MurA
Residue:
421
Sequence:
MDKLIITGGNRLDGEIRISGAKNSALPILAATLLADTPVTVCNLPHLHDITTMIELFGRMGVQPIIDEKLNVEVDASSIKTLVAPYELVKTMRASILVLGPMLARFGEAEVALPGGCAIGSRPVDLHIRGLEAMGAQIEVEGGYIKAKAPAGGLRGGHFFFDTVSVTGTENLMMAAALANGRTVLQNAAREPEVVDLANCLNAMGANVQGAGSDTIVIEGVKRLGGARYDVLPDRIETGTYLVAAAATGGRVKLKDTDPTILEAVLQKLEEAGAHISTGSNWIELDMKGNRPKAVNVRTAPYPAFPTDMQAQFISMNAVAEGTGAVIETVFENRFMHVYEMNRMGAQILVEGNTAIVTGVPKLKGAPVMATDLRASASLVIAGLVAEGDTLIDRIYHIDRGYECIEEKLQLLGAKIRRVPG
  
Inhibitor
Name:
BDBM50370832
Synonyms:
CNICIN
Type:
Small organic molecule
Emp. Form.:
C20H26O7
Mol. Mass.:
378.4162
SMILES:
CC1=CCC\C(CO)=C\[C@H]2OC(=O)C(=C)[C@@H]2[C@H](C1)OC(=O)C(=C)[C@H](O)CO |r,t:7|
Structure:
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