DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
GTPase KRas
Ligand Name
4-(2,3-dihydro-1,4-benzodioxin-5-yl)-~{N}-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-aniline
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
LEFMIEUBWDMNAT-UHFFFAOYSA-N
SMILES
CN(C)Cc1cccc(c1)Nc2ccc(cc2OC)c3cccc4c3OCCO4
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 6F76
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 atomse6f76A1e6f76B1e6f76C1e6f76D1e6f76E1e6f76F1
ECOD domains from experimental PDB structures interacting with ligand CVK
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P01116n/aCVK6f76e6f76A1A:-3-168
P01116n/aCVK6f76e6f76B1B:-3-168
P01116n/aCVK6f76e6f76C1C:-3-168
P01116n/aCVK6f76e6f76D1D:-3-167
P01116n/aCVK6f76e6f76E1E:-3-169
P01116n/aCVK6f76e6f76F1F:-3-168