DrugDomain logoDrugDomain

Attributes

UniProt ID
Q965D7
Protein Name
3-hydroxyacyl- dehydratase
Ligand Name
8-(benzyloxy)-5-chloroquinoline
DrugBank ID
None
PDB Ligand Accession
KM0
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
LPPVIXWNCVGAJV-UHFFFAOYSA-N
SMILES
c1ccc(cc1)COc2ccc(c3c2nccc3)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Mol*
Structure: 3AZA
Open File
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 atomse3azaA2e3azaB2e3azaC2e3azaD2e3azaE2e3azaF2e3azaG2e3azaH2e3azaI2e3azaJ2e3azaK2e3azaL2e3azaM2e3azaN2e3azaO2e3azaP2e3azaQ2e3azaR2e3azaS2e3azaT2e3azaU2e3azaV2e3azaW2e3azaX2
ECOD domains from experimental PDB structures interacting with ligand KM0
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q965D7n/aKM03azae3azaA2A:84-229
Q965D7n/aKM03azae3azaB2B:85-228
Q965D7n/aKM03azae3azaC2C:85-228
Q965D7n/aKM03azae3azaD2D:84-227
Q965D7n/aKM03azae3azaM2M:84-229
Q965D7n/aKM03azae3azaN2N:85-229
Q965D7n/aKM03azae3azaO2O:85-228
Q965D7n/aKM03azae3azaP2P:84-227
Q965D7n/aKM03azae3azaQ2Q:84-228
Q965D7n/aKM03azae3azaR2R:84-229
Q965D7n/aKM03azae3azaU2U:85-228
Q965D7n/aKM03azae3azaV2V:84-227