DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Hematopoietic prostaglandin D synthase
Ligand Name
4-(dimethylamino)-N-[5-(1H-indol-4-yl)pyridin-3-yl]butanamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
QVBOWRMZONBBIK-UHFFFAOYSA-N
SMILES
CN(C)CCCC(=O)Nc1cc(cnc1)c2cccc3c2cc[nH]3
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 5AIS
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 atomse5aisA1e5aisA2e5aisB1e5aisB2e5aisC1e5aisC2e5aisD1e5aisD2
ECOD domains from experimental PDB structures interacting with ligand CWC
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
O60760n/aCWC5aise5aisA1A:2-73
O60760n/aCWC5aise5aisA2A:74-199
O60760n/aCWC5aise5aisB1B:2-73
O60760n/aCWC5aise5aisB2B:74-199
O60760n/aCWC5aise5aisC1C:74-199
O60760n/aCWC5aise5aisC2C:2-73
O60760n/aCWC5aise5aisD1D:2-73
O60760n/aCWC5aise5aisD2D:74-199