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Target
Beta-lactamase
Ligand
BDBM50330325
Substrate
n/a
Meas. Tech.
ChEMBL_839908 (CHEMBL2090109)
IC50
1060000±n/a nM
Citation
 Chen, P; Horton, LB; Mikulski, RL; Deng, L; Sundriyal, S; Palzkill, T; Song, Y 2-Substituted 4,5-dihydrothiazole-4-carboxylic acids are novel inhibitors of metallo-ß-lactamases. Bioorg Med Chem Lett 22:6229-32 (2012) [PubMed]  Article 
Target
Name:
Beta-lactamase
Synonyms:
BAS3245 | Beta-lactamase (Bla2) | Beta-lactamase II | GBAA_3500 | bla2
Type:
Enzyme
Mol. Mass.:
28177.23
Organism:
Bacillus anthracis
Description:
Q93T40
Residue:
256
Sequence:
MKNTLLKLGVCVSLLGITPFVSTISSVQAERKVEHKVIKNETGTISISQLNKNVWVHTELGYFNGEAVPSNGLILNTSKGLVLVDSSWDDKLTKELIEMAEKKFKKSVTDVIITHAHADRIGGIKTLKERGIKAHSTTLTAELAKKNGYEEPLGDLQAITKLKFGNMKVETFYPGKGHTEDNIVVWLPQYNMLVGGCLVKSASAKDLGNITDAYVNEWSTSIENVLKRYENINFVVPGHGEVGDKGLLLHTLDLLK
  
Inhibitor
Name:
BDBM50330325
Synonyms:
2,2',2'',2'''-(ethane-1,2-diylbis(azanetriyl))tetraacetic acid | CHEMBL858 | Edetate | Edetic Acid | [{2-[bis(carboxymethyl)amino]ethyl}(carboxymethyl)amino]acetic acid | edta | {[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]-CARBOXYMETHYL-AMINO}-ACETIC ACID | {[2-(Bis-carboxymethyl-amino)-ethyl]-carboxymethyl-amino}-acetic acid | {[2-(Bis-carboxymethyl-amino)-ethyl]-carboxymethyl-amino}-acetic acid(EDTA)
Type:
Small organic molecule
Emp. Form.:
C10H16N2O8
Mol. Mass.:
292.2426
SMILES:
OC(=O)CN(CCN(CC(O)=O)CC(O)=O)CC(O)=O
Structure:
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