DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Heat shock protein HSP 90-alpha
Ligand Name
N~3~-benzyl-2-[(6-bromo-1,3-benzodioxol-5-yl)methyl]imidazo[1,2-a]pyrazine-3,8-diamine
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
QOEANVPMVDTINQ-UHFFFAOYSA-N
SMILES
c1ccc(cc1)CNc2c(nc3n2ccnc3N)Cc4cc5c(cc4Br)OCO5
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 4R3M
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 atomse4r3mA1
ECOD domains from experimental PDB structures interacting with ligand JR9
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P07900n/aJR94r3me4r3mA1A:16-224