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Target
UDP-N-acetylglucosamine 1-carboxyvinyltransferase
Ligand
BDBM50607397
Substrate
n/a
Meas. Tech.
ChEMBL_2262628 (CHEMBL5217639)
IC50
6100±n/a nM
Citation
 Fathalla, RK; Fröhner, W; Bader, CD; Fischer, PD; Dahlem, C; Chatterjee, D; Mathea, S; Kiemer, AK; Arthanari, H; Müller, R; Abdel-Halim, M; Ducho, C; Engel, M Identification and Biochemical Characterization of Pyrrolidinediones as Novel Inhibitors of the Bacterial Enzyme MurA. J Med Chem 65:14740-14763 (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:
BDBM50607397
Synonyms:
CHEMBL5220390
Type:
Small organic molecule
Emp. Form.:
C27H19F3N2O4S
Mol. Mass.:
524.511
SMILES:
CCOC(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)-c1ccccc1)c1nc2ccc(cc2s1)C(F)(F)F |c:5|
Structure:
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