Attributes
UniProt ID
Protein Name
3-hydroxy-3-methylglutaryl-coenzyme A reductase
Ligand Name
3-HYDROXY-3-METHYLGLUTARYL-COENZYME A
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
CABVTRNMFUVUDM-VRHQGPGLSA-I
SMILES
CC(C)(COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)n2cnc3c2ncnc3N)O)OP(=O)([O-])[O-])C(C(=O)NCCC(=O)NCCSC(=O)CC(C)(CC(=O)[O-])O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 1DQ9
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 atomse1dq9A1e1dq9A2e1dq9B1e1dq9B2e1dq9C1e1dq9C2e1dq9D1e1dq9D2
ECOD domains from experimental PDB structures interacting with ligand DB03169
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P04035 | DB03169 | HMG | 1dq9 | e1dq9A1 | A:587-703 |
| P04035 | DB03169 | HMG | 1dq9 | e1dq9A2 | A:462-586,A:704-865 |
| P04035 | DB03169 | HMG | 1dq9 | e1dq9B1 | B:587-703 |
| P04035 | DB03169 | HMG | 1dq9 | e1dq9B2 | B:462-586,B:704-864 |
| P04035 | DB03169 | HMG | 1dq9 | e1dq9C1 | C:587-703 |
| P04035 | DB03169 | HMG | 1dq9 | e1dq9C2 | C:462-586,C:704-866 |
| P04035 | DB03169 | HMG | 1dq9 | e1dq9D1 | D:587-703 |
| P04035 | DB03169 | HMG | 1dq9 | e1dq9D2 | D:462-586,D:704-865 |