Reaction Details Report a problem with these data
Target
Beta-lactamase CTX-M-1
Ligand
BDBM36449
Substrate
n/a
Meas. Tech.
Beta-lactamase CTX-M Inhibition Assay
pH
7±0
Ki
10000±0.0 nM
Citation
 Chen, Y; Shoichet, BK Molecular docking and ligand specificity in fragment-based inhibitor discovery. Nat Chem Biol 5:358-64 (2009) [PubMed]  Article 
Target
Name:
Beta-lactamase CTX-M-1
Synonyms:
BLC1_ECOLX | Beta-lactamase (CTX-M) | bla | class A beta-lactamase CTX-M-1 | men1
Type:
Protien
Mol. Mass.:
31251.38
Organism:
Escherichia coli
Description:
Q7AVW6
Residue:
291
Sequence:
MVKKSLRQFTLMATATVTLLLGSVPLYAQTADVQQKLAELERQSGGRLGVALINTADNSQILYRADERFAMCSTSKVMAVAAVLKKSESEPNLLNQRVEIKKSDLVNYNPIAEKHVDGTMSLAELSAAALQYSDNVAMNKLISHVGGPASVTAFARQLGDETFRLDRTEPTLNTAIPGDPRDTTSPRAMAQTLRNLTLGKALGDSQRAQLVTWMKGNTTGAASIQAGLPASWVVGDKTGSGDYGTTNDIAVIWPKDRAPLILVTYFTQPQPKAESRRDVLASAAKIVTNGL
  
Inhibitor
Name:
BDBM36449
Synonyms:
CID25181262 | ZINC12596968, 13
Type:
Small organic molecule
Emp. Form.:
C17H13N6O
Mol. Mass.:
317.3253
SMILES:
Cn1cc(C(=O)Nc2cccc(c2)-c2nn[n-]n2)c2ccccc12
Structure:
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