Attributes
UniProt ID
Protein Name
Hydroxymethylglutaryl-CoA synthase, mitochondrial
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: 2WYA
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Color Legend
Unassigned regionsLigand / hetero atomse2wyaA1e2wyaA2e2wyaB1e2wyaB2e2wyaC1e2wyaC2e2wyaD1e2wyaD2
ECOD domains from experimental PDB structures interacting with ligand DB03169
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P54868 | DB03169 | HMG | 2wya | e2wyaA1 | A:49-222 |
| P54868 | DB03169 | HMG | 2wya | e2wyaA2 | A:223-316,A:340-508 |
| P54868 | DB03169 | HMG | 2wya | e2wyaB1 | B:49-222 |
| P54868 | DB03169 | HMG | 2wya | e2wyaB2 | B:223-316,B:340-508 |
| P54868 | DB03169 | HMG | 2wya | e2wyaC1 | C:223-316,C:340-508 |
| P54868 | DB03169 | HMG | 2wya | e2wyaC2 | C:49-222 |
| P54868 | DB03169 | HMG | 2wya | e2wyaD1 | D:49-222 |
| P54868 | DB03169 | HMG | 2wya | e2wyaD2 | D:223-316,D:340-508 |