Reaction Details Report a problem with these data
Target
Beta-lactamase
Ligand
BDBM14672
Substrate
n/a
Meas. Tech.
ChEMBL_571690 (CHEMBL1032138)
pH
5±n/a
Ki
490000±n/a nM
Comments
extracted
Citation
 Beck, J; Vercheval, L; Bebrone, C; Herteg-Fernea, A; Lassaux, P; Marchand-Brynaert, J Discovery of novel lipophilic inhibitors of OXA-10 enzyme (class D beta-lactamase) by screening amino analogs and homologs of citrate and isocitrate. Bioorg Med Chem Lett 19:3593-7 (2009) [PubMed]  Article 
Target
Name:
Beta-lactamase
Synonyms:
BLAC_BACLI | blaP | penP
Type:
PROTEIN
Mol. Mass.:
33993.80
Organism:
Bacillus licheniformis
Description:
ChEMBL_571690
Residue:
307
Sequence:
MKLWFSTLKLKKAAAVLLFSCVALAGCANNQTNASQPAEKNEKTEMKDDFAKLEEQFDAKLGIFALDTGTNRTVAYRPDERFAFASTIKALTVGVLLQQKSIEDLNQRITYTRDDLVNYNPITEKHVDTGMTLKELADASLRYSDNAAQNLILKQIGGPESLKKELRKIGDEVTNPERFEPELNEVNPGETQDTSTARALVTSLRAFALEDKLPSEKRELLIDWMKRNTTGDALIRAGVPDGWEVADKTGAASYGTRNDIAIIWPPKGDPVVLAVLSSRDKKDAKYDDKLIAEATKVVMKALNMNGK
  
Inhibitor
Name:
BDBM14672
Synonyms:
2-hydroxypropane-1,2,3-tricarboxylic acid | CHEMBL1261 | Citrate | Citric Acid | Fragment 2 | cid_311
Type:
Small organic molecule
Emp. Form.:
C6H8O7
Mol. Mass.:
192.1235
SMILES:
OC(=O)CC(O)(CC(O)=O)C(O)=O
Structure:
Search PDB for entries with ligand similarity: