Target
Aldo-keto reductase family 1 member B1
Ligand
BDBM16437
Substrate
BDBM16418
Meas. Tech.
Enzyme Inhibition Assay
Ki
8100±n/a nM
Citation
 Brownlee, JMCarlson, EMilne, ACPape, EHarrison, DH Structural and thermodynamic studies of simple aldose reductase-inhibitor complexes. Bioorg Chem 34:424-44 (2006) [PubMed]  Article 
Target
Name:
Aldo-keto reductase family 1 member B1
Synonyms:
AKR1B1 | ALDR1 | ALDR_HUMAN | ALR2 | AR | Aldo-keto reductase family 1 member B1 (AKR1B1) | Aldose Reductase (ALR2) | Aldose reductase | Aldose reductase (AR)
Type:
Protein
Mol. Mass.:
35855.50
Organism:
Homo sapiens (Human)
Description:
P15121. 4LAU; 2IKI; 4LB4; 2FZD; 2FZ8; 1US0
Residue:
316
Sequence:
MASRLLLNNGAKMPILGLGTWKSPPGQVTEAVKVAIDVGYRHIDCAHVYQNENEVGVAIQEKLREQVVKREELFIVSKLWCTYHEKGLVKGACQKTLSDLKLDYLDLYLIHWPTGFKPGKEFFPLDESGNVVPSDTNILDTWAAMEELVDEGLVKAIGISNFNHLQVEMILNKPGLKYKPAVNQIECHPYLTQEKLIQYCQSKGIVVTAYSPLGSPDRPWAKPEDPSLLEDPRIKAIAAKHNKTTAQVLIRFPMQRNLVVIPKSVTPERIAENFKVFDFELSSQDMTTLLSYNRNWRVCALLSCTSHKDYPFHEEF
  
Inhibitor
Name:
BDBM16437
Synonyms:
2-{3-[(2-hydroxyethyl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}acetic acid | beta-Mercaptoethanol , N-glycylthiosuccinimide
Type:
adduct
Emp. Form.:
C8H11NO5S
Mol. Mass.:
233.242
SMILES:
OCCSC1CC(=O)N(CC(O)=O)C1=O
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
BDBM16418
Synonyms:
benzyl alcohol | phenylmethanol
Type:
Small organic molecule
Emp. Form.:
C7H8O
Mol. Mass.:
108.1378
SMILES:
OCc1ccccc1
Structure:
Search PDB for entries with ligand similarity: