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Target
Beta-lactamase
Ligand
BDBM50079679
Substrate
n/a
Meas. Tech.
ChEMBL_41050 (CHEMBL650472)
IC50
9510±n/a nM
Citation
 Buynak, JD; Rao, AS; Doppalapudi, VR; Adam, G; Petersen, PJ; Nidamarthy, SD The synthesis and evaluation of 6-alkylidene-2'beta-substituted penam sulfones as beta-lactamase inhibitors. Bioorg Med Chem Lett 9:1997-2002 (1999) [PubMed]  Article 
Target
Name:
Beta-lactamase
Synonyms:
BLAC_STAAU | Beta-lactamase TEM | Penicillinase | blaZ
Type:
PROTEIN
Mol. Mass.:
31367.53
Organism:
Staphylococcus aureus
Description:
ChEMBL_41052
Residue:
281
Sequence:
MKKLIFLIVIALVLSACNSNSSHAKELNDLEKKYNAHIGVYALDTKSGKEVKFNSDKRFAYASTSKAINSAILLEQVPYNKLNKKVHINKDDIVAYSPILEKYVGKDITLKALIEASMTYSDNTANNKIIKEIGGIKKVKQRLKELGDKVTNPVRYEIELNYYSPKSKKDTSTPAAFGKTLNKLIANGKLSKENKKFLLDLMLNNKSGDTLIKDGVPKDYKVADKSGQAITYASRNDVAFVYPKGQSEPIVLVIFTNKDNKSDKPNDKLISETAKSVMKEF
  
Inhibitor
Name:
BDBM50079679
Synonyms:
CHEMBL64056 | sodium (2S,3R,5R,6Z)-3-[(acetyloxy)methyl]-6-(2-methoxy-2-oxoethylidene)-3-methyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate 4,4-dioxide
Type:
Small organic molecule
Emp. Form.:
C13H14NO9S
Mol. Mass.:
360.317
SMILES:
COC(=O)\C=C1/C2N([C@@H](C([O-])=O)[C@](C)(COC(C)=O)S2(=O)=O)C1=O
Structure:
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