Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetGlutathione S-transferase A1
LigandBDBM50043762
Substrate/Competitorn/a
Meas. Tech.ChEMBL_72446 (CHEMBL682616)
Ki 24300±n/a nM
Citation Lyttle, MHHocker, MDHui, HCCaldwell, CGAaron, DTEngqvist-Goldstein, AFlatgaard, JEBauer, KE Isozyme-specific glutathione-S-transferase inhibitors: design and synthesis. J Med Chem37:189-94 (1994) [PubMed]
More Info.:Get all data from this article,  Assay Method
 
Glutathione S-transferase A1
Name:Glutathione S-transferase A1
Synonyms:GST class-alpha member 1 | GST-epsilon | GSTA1 | GSTA1-1 | GSTA1_HUMAN | GTH1 | Glutathione S-transferase (GST) | HA subunit 1
Type:Enzyme
Mol. Mass.:25636.31
Organism:Homo sapiens (Human)
Description:Glutathione-S-Transferase (GST, N-terminally)
Residue:222
Sequence:
MAEKPKLHYFNARGRMESTRWLLAAAGVEFEEKFIKSAEDLDKLRNDGYLMFQQVPMVEI
DGMKLVQTRAILNYIASKYNLYGKDIKERALIDMYIEGIADLGEMILLLPVCPPEEKDAK
LALIKEKIKNRYFPAFEKVLKSHGQDYLVGNKLSRADIHLVELLYYVEELDSSLISSFPL
LKALKTRISNLPTVKKFLQPGSPRKPPMDEKSLEEARKIFRF
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50043762
n/a
NameBDBM50043762
Synonyms:2-Amino-4-{2-benzylsulfanyl-1-[(carboxy-phenyl-methyl)-carbamoyl]-ethylcarbamoyl}-butyric acid | CHEMBL58951
TypeSmall organic molecule
Emp. Form.C23H27N3O6S
Mol. Mass.473.542
SMILESNC(CCC(=O)NC(CSCc1ccccc1)C(=O)NC(C(O)=O)c1ccccc1)C(O)=O
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: