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: 1QAX
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Color Legend
Unassigned regionsLigand / hetero atomse1qaxA2e1qaxA3e1qaxA4e1qaxB1e1qaxB2
ECOD domains from experimental PDB structures interacting with ligand DB03169
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P13702 | DB03169 | HMG | 1qax | e1qaxA3 | A:379-428 |
| P13702 | DB03169 | HMG | 1qax | e1qaxA4 | A:4-110,A:221-378 |
| P13702 | DB03169 | HMG | 1qax | e1qaxB1 | B:611-720 |
| P13702 | DB03169 | HMG | 1qax | e1qaxB2 | B:504-610,B:721-875 |
| P13702 | DB03169 | HMG | 4i6a | e4i6aA2 | A:3-110,A:221-378 |
| P13702 | DB03169 | HMG | 4i6a | e4i6aB1 | B:611-720 |
| P13702 | DB03169 | HMG | 4i6a | e4i6aB2 | B:503-610,B:721-878 |