DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Branched-chain-amino-acid aminotransferase, mitochondrial
Ligand Name
7-oxo-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-5-propyl-4,7-dihydropyrazolo[1,5-a]pyrimidine-3-carbonitrile
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
IBJDXQJWRXJZBH-UHFFFAOYSA-N
SMILES
CCCC1=CC(=O)n2c(c(c(n2)CC(=O)N3CCCC3)C#N)N1
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 5BWW
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomse5bwwA1e5bwwA2e5bwwB1e5bwwB2
ECOD domains from experimental PDB structures interacting with ligand 4W6
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
O15382n/a4W65bwwe5bwwA1A:172-365
O15382n/a4W65bwwe5bwwA2A:3-171
O15382n/a4W65bwwe5bwwB1B:172-365
O15382n/a4W65bwwe5bwwB2B:2-171