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Target
UDP-N-acetylglucosamine 1-carboxyvinyltransferase
Ligand
BDBM50589511
Substrate
n/a
Meas. Tech.
ChEMBL_2193722 (CHEMBL5106082)
IC50
15500±n/a nM
Citation
 Proj, M; Bozovi?ar, K; Hrast, M; Frlan, R; Gobec, S DNA-encoded library screening on two validated enzymes of the peptidoglycan biosynthetic pathway. Bioorg Med Chem Lett 73:0 (2022) [PubMed] 
Target
Name:
UDP-N-acetylglucosamine 1-carboxyvinyltransferase
Synonyms:
EPT | Enoylpyruvate transferase | MURA_ECOLI | MurA (E. coli) | UDP-N-acetylglucosamine 1-carboxyvinyltransferase | UDP-N-acetylglucosamine enolpyruvyl transferase | murA | murZ
Type:
Protein
Mol. Mass.:
44814.62
Organism:
Escherichia coli K-12 (Enterobacteria)
Description:
E. coli MurA
Residue:
419
Sequence:
MDKFRVQGPTKLQGEVTISGAKNAALPILFAALLAEEPVEIQNVPKLKDVDTSMKLLSQLGAKVERNGSVHIDARDVNVFCAPYDLVKTMRASIWALGPLVARFGQGQVSLPGGCTIGARPVDLHISGLEQLGATIKLEEGYVKASVDGRLKGAHIVMDKVSVGATVTIMCAATLAEGTTIIENAAREPEIVDTANFLITLGAKISGQGTDRIVIEGVERLGGGVYRVLPDRIETGTFLVAAAISRGKIICRNAQPDTLDAVLAKLRDAGADIEVGEDWISLDMHGKRPKAVNVRTAPHPAFPTDMQAQFTLLNLVAEGTGFITETVFENRFMHVPELSRMGAHAEIESNTVICHGVEKLSGAQVMATDLRASASLVLAGCIAEGTTVVDRIYHIDRGYERIEDKLRALGANIERVKGE
  
Inhibitor
Name:
BDBM50589511
Synonyms:
CHEMBL5199836
Type:
Small organic molecule
Emp. Form.:
C38H32N6O3
Mol. Mass.:
620.6991
SMILES:
CNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NCc1ccc(c(c1)-c1ccc(cc1)-c1cc(C(O)=O)c2ccccc2n1)-n1ccnc1 |r|
Structure:
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