Reaction Details Report a problem with these data
Target
Beta-lactamase
Ligand
BDBM50067886
Substrate
n/a
Meas. Tech.
ChEMBL_35527 (CHEMBL649553)
Ki
4200±n/a nM
Citation
 Powers, RA; Shoichet, BK Structure-based approach for binding site identification on AmpC beta-lactamase. J Med Chem 45:3222-34 (2002) [PubMed]  Article 
Target
Name:
Beta-lactamase
Synonyms:
AMPC_ECOLI | Beta-lactamase | Beta-lactamase (AmpC) | Beta-lactamase AmpC | Cephalosporinase | Escherichia coli K-12 | ampA | ampC
Type:
Protien
Mol. Mass.:
41561.62
Organism:
Escherichia coli
Description:
P00811
Residue:
377
Sequence:
MFKTTLCALLITASCSTFAAPQQINDIVHRTITPLIEQQKIPGMAVAVIYQGKPYYFTWGYADIAKKQPVTQQTLFELGSVSKTFTGVLGGDAIARGEIKLSDPTTKYWPELTAKQWNGITLLHLATYTAGGLPLQVPDEVKSSSDLLRFYQNWQPAWAPGTQRLYANSSIGLFGALAVKPSGLSFEQAMQTRVFQPLKLNHTWINVPPAEEKNYAWGYREGKAVHVSPGALDAEAYGVKSTIEDMARWVQSNLKPLDINEKTLQQGIQLAQSRYWQTGDMYQGLGWEMLDWPVNPDSIINGSDNKIALAARPVKAITPPTPAVRASWVHKTGATGGFGSYVAFIPEKELGIVMLANKNYPNPARVDAAWQILNALQ
  
Inhibitor
Name:
BDBM50067886
Synonyms:
3-(4-boronophenyl)acrylic acid | 4-(CARBOXYVIN-2-YL)PHENYLBORONIC ACID | 4-phenylpropylester boronic acid | CHEMBL139928
Type:
Small organic molecule
Emp. Form.:
C9H9BO4
Mol. Mass.:
191.976
SMILES:
OB(O)c1ccc(\C=C\C(O)=O)cc1
Structure:
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