DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Polyketide synthase Pks13
Ligand Name
~{N}-[(1~{R})-2-[4-(azetidin-1-ylcarbonyl)phenyl]-1-cyano-ethyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole-5-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
SMNJIXFCHIEXRX-GOSISDBHSA-N
SMILES
COc1ccc(cc1OC)c2nc(on2)C(=O)NC(Cc3ccc(cc3)C(=O)N4CCC4)C#N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 8Q0U
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 atomse8q0uA1e8q0uB1
ECOD domains from experimental PDB structures interacting with ligand IKG
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
I6X8D2n/aIKG8q0ue8q0uA1A:1451-1727
I6X8D2n/aIKG8q0ue8q0uB1B:1451-1727