Reaction Details Report a problem with these data
Target
Beta-lactamase
Ligand
BDBM50022788
Substrate
n/a
Meas. Tech.
ChEMBL_693673 (CHEMBL1637941)
IC50
4±n/a nM
Citation
 Zioga, A; Whichard, JM; Kotsakis, SD; Tzouvelekis, LS; Tzelepi, E; Miriagou, V CMY-31 and CMY-36 cephalosporinases encoded by ColE1-like plasmids. Antimicrob Agents Chemother 53:1256-9 (2009) [PubMed]  Article 
Target
Name:
Beta-lactamase
Synonyms:
LAT-2 b-lactamase | LAT-2 | Class C beta-lactamase CMY-36
Type:
PROTEIN
Mol. Mass.:
42045.45
Organism:
Pseudomonas aeruginosa (g-Proteobacteria)
Description:
ChEMBL_693673
Residue:
381
Sequence:
MMKKSLCCALLLTASFSTFAAAKTEQQIADIVNRTITPLMQEQAIPGMAVAVIYQGKPYYFTWGKADIANNHPVTQQTLFELGSVSKTFNGVLGGDCIARGEIKLSDPVTKYWPELTGKQWQGIRLLHLATYTAGGLPLQIPDDVRDKAALLHFYQNWQPQWTPGAKRLYANSSIGLFGALAVKPSGMSYEEAMTRRVLQPLKLAHTWITVPENEQKDYAWGYREGKPVHVSPGQLDAEAYGVKSSVIDMARWVQANMDASHVQEKTLQQGIALAQSRYWRIGDMYQGLGWEMLNWPLKADSIINGSDSKVALAALPAVEVNPPAPAVKASWVHKTGSTGGFGSYVAFVPEKNLGIVMLANKSYPNPVRVEAAWRILEKLQ
  
Inhibitor
Name:
BDBM50022788
Synonyms:
(2S,5R,6R)-6-(3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamido)-3,3-dimethyl-7-oxo-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carboxylic acid | (2S,5R,6R)-6-{[3-(2-Chloro-phenyl)-5-methyl-isoxazole-4-carbonyl]-amino}-3,3-dimethyl-7-oxo-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carboxylic acid | 6-{[3-(2-Chloro-phenyl)-5-methyl-isoxazole-4-carbonyl]-amino}-3,3-dimethyl-7-oxo-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carboxylic acid | CLOXAPEN | TEGOPEN | cloxacillin | CHEMBL891
Type:
Small organic molecule
Emp. Form.:
n/a
Mol. Mass.:
n/a
SMILES:
Cc1onc(c1C(=O)N[C@H]1[C@H]2SC(C)(C)[C@@H](N2C1=O)C(O)=O)-c1ccccc1Cl |r|
Structure:
Search PDB for entries with ligand similarity: