BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetBeta-lactamase
LigandBDBM83263
Substrate/Competitorn/a
Meas. Tech.Counterscreen for inhibitors of TLR9-MyD88 binding: fluorescence-based cell-based high throughput dose response assay to identify non-selective inhibitors of the beta-lactamase enzyme (BLA)
IC50 3709±n/a nM
Citation PubChem, PC Counterscreen for inhibitors of TLR9-MyD88 binding: fluorescence-based cell-based high throughput dose response assay to identify non-selective inhibitors of the beta-lactamase enzyme (BLA) PubChem Bioassay(2011)[AID]
More Info.:Get all data from this article,  Assay Method
 
Beta-lactamase
Name:Beta-lactamase
Synonyms:Beta lactamase
Type:Enzyme Catalytic Domain
Mol. Mass.:31513.38
Organism:Pseudomonas aeruginosa
Description:gi_114881106
Residue:286
Sequence:
MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDKLGARVGYIELDLNSGKILESFRP
EERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVEYSPVTEKHLTDGMTVREL
CSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDRWEPELNEAIPNDERDTTM
PAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGAGERGS
RGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM83263
n/a
NameBDBM83263
Synonyms:MLS001065937 | N-butyl-2-(4-cyclohexylsulfanylphenyl)imidazo[1,2-a]pyrazin-3-amine | N-butyl-2-[4-(cyclohexylthio)phenyl]-3-imidazo[1,2-a]pyrazinamine | SMR000814582 | butyl-[2-[4-(cyclohexylthio)phenyl]imidazo[1,2-a]pyrazin-3-yl]amine | cid_42601124
TypeSmall organic molecule
Emp. Form.C22H28N4S
Mol. Mass.380.55
SMILESCCCCNc1c(nc2cnccn12)-c1ccc(SC2CCCCC2)cc1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: