DrugDomain logoDrugDomain

Attributes

UniProt ID
Q9HTJ1
Protein Name
NAD/NADP-dependent betaine aldehyde dehydrogenase
Ligand Name
2-{2-[2-(2-{2-[2-(2-ETHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHOXY]-ETHOXY}-ETHANOL
DrugBank ID
None
PDB Ligand Accession
PE4
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
PJWQOENWHPEPKI-UHFFFAOYSA-N
SMILES
CCOCCOCCOCCOCCOCCOCCOCCO
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Mol*
Structure: 4CAZ
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Color Legend
Unassigned regionsLigand / hetero atomse4cazA1e4cazA2e4cazB1e4cazB2
ECOD domains from experimental PDB structures interacting with ligand PE4
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q9HTJ1n/aPE44caze4cazA1A:255-490
Q9HTJ1n/aPE44caze4cazA2A:2-254
Q9HTJ1n/aPE44caze4cazB1B:2-254
Q9HTJ1n/aPE44caze4cazB2B:255-490
Q9HTJ1n/aPE44cbbe4cbbA1A:2-254
Q9HTJ1n/aPE44cbbe4cbbA2A:255-490
Q9HTJ1n/aPE44cbbe4cbbB1B:255-490
Q9HTJ1n/aPE44cbbe4cbbB2B:2-254
Q9HTJ1n/aPE44cbbe4cbbC1C:2-254
Q9HTJ1n/aPE44cbbe4cbbC2C:255-490
Q9HTJ1n/aPE44cbbe4cbbD1D:255-490
Q9HTJ1n/aPE44cbbe4cbbD2D:2-254
Q9HTJ1n/aPE44cbbe4cbbE1E:2-254
Q9HTJ1n/aPE44cbbe4cbbE2E:255-490
Q9HTJ1n/aPE44cbbe4cbbF1F:2-254
Q9HTJ1n/aPE44cbbe4cbbF2F:255-490
Q9HTJ1n/aPE44cbbe4cbbG1G:255-490
Q9HTJ1n/aPE44cbbe4cbbG2G:2-254
Q9HTJ1n/aPE44cbbe4cbbH1H:2-254
Q9HTJ1n/aPE44cbbe4cbbH2H:255-490