Reaction Details Report a problem with these data
Target
Beta-lactamase
Ligand
BDBM50021956
Substrate
n/a
Meas. Tech.
ChEBML_41049
IC50
260±n/a nM
Citation
Micetich, RG; Maiti, SN; Spevak, P; Hall, TW; Yamabe, S; Ishida, N; Tanaka, M; Yamazaki, T; Nakai, A; Ogawa, K Synthesis and beta-lactamase inhibitory properties of 2 beta-[(1,2,3-triazol-1-yl)methyl]-2 alpha-methylpenam-3 alpha-carboxylic acid 1,1-dioxide and related triazolyl derivatives. J Med Chem 30:1469-74 (1987) [PubMed] Article
More Info.:
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:
BDBM50021956
Synonyms:
CHEMBL285387 | Sodium; 3-methyl-2,2,6-trioxo-3-[1,2,3]triazol-1-ylmethyl-2lambda*6*-thia-bicyclo[3.2.0]heptane-4-carboxylate
Type:
Small organic molecule
Emp. Form.:
C11H12N3O5S
Mol. Mass.:
298.296
SMILES:
C[C@]1(Cn2ccnn2)[C@@H](C2C(CC2=O)S1(=O)=O)C([O-])=O