Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetChymotrypsinogen B
LigandBDBM50024092
Substrate/Competitorn/a
Meas. Tech.ChEMBL_216620 (CHEMBL819192)
Ki 5.3±n/a nM
Citation Sofia, MJKatzenellenbogen, JA Enol lactone inhibitors of serine proteases. The effect of regiochemistry on the inactivation behavior of phenyl-substituted (halomethylene)tetra- and -dihydrofuranones and (halomethylene)tetrahydropyranones toward alpha-chymotrypsin: stable acyl enzyme intermediate. J Med Chem29:230-8 (1986) [PubMed]
More Info.:Get all data from this article,  Assay Method
 
Chymotrypsinogen B
Name:Chymotrypsinogen B
Synonyms:Beta-chymotrypsin | CTRB | CTRB1 | CTRB1_HUMAN | Chymotrypsin B chain A | Chymotrypsin B chain B | Chymotrypsin B chain C | Chymotrypsinogen B | Synonyms=CTRB
Type:PROTEIN
Mol. Mass.:27713.98
Organism:Homo sapiens (Human)
Description:ChEMBL_10909
Residue:263
Sequence:
MASLWLLSCFSLVGAAFGCGVPAIHPVLSGLSRIVNGEDAVPGSWPWQVSLQDKTGFHFC
GGSLISEDWVVTAAHCGVRTSDVVVAGEFDQGSDEENIQVLKIAKVFKNPKFSILTVNND
ITLLKLATPARFSQTVSAVCLPSADDDFPAGTLCATTGWGKTKYNANKTPDKLQQAALPL
LSNAECKKSWGRRITDVMICAGASGVSSCMGDSGGPLVCQKDGAWTLVGIVSWGSDTCST
SSPGVYARVTKLIPWVQKILAAN
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50024092
n/a
NameBDBM50024092
Synonyms:6-Iodomethylene-4-phenyl-tetrahydro-pyran-2-one | CHEMBL307448
TypeSmall organic molecule
Emp. Form.C12H11IO2
Mol. Mass.314.119
SMILESI\C=C1/CC(CC(=O)O1)c1ccccc1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: