Attributes
UniProt ID
Protein Name
3-hydroxy-3-methylglutaryl-coenzyme A reductase
Ligand Name
7-[2-(4-FLUORO-PHENYL)-5-ISOPROPYL-3-PHENYL-4-PHENYLCARBAMOYL-PYRROL-1-YL]- 3,5-DIHYDROXY-HEPTANOIC ACID
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
XUKUURHRXDUEBC-KAYWLYCHSA-N
SMILES
CC(C)c1c(c(c(n1CCC(CC(CC(=O)O)O)O)c2ccc(cc2)F)c3ccccc3)C(=O)Nc4ccccc4
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 1HWK
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Color Legend
Unassigned regionsLigand / hetero atomse1hwkA1e1hwkA2e1hwkB1e1hwkB2e1hwkC1e1hwkC2e1hwkD1e1hwkD2
ECOD domains from experimental PDB structures interacting with ligand DB01076
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P04035 | DB01076 | 117 | 1hwk | e1hwkA1 | A:587-703 |
| P04035 | DB01076 | 117 | 1hwk | e1hwkA2 | A:450-586,A:704-850 |
| P04035 | DB01076 | 117 | 1hwk | e1hwkB1 | B:587-703 |
| P04035 | DB01076 | 117 | 1hwk | e1hwkB2 | B:463-586,B:704-856 |
| P04035 | DB01076 | 117 | 1hwk | e1hwkC1 | C:587-703 |
| P04035 | DB01076 | 117 | 1hwk | e1hwkC2 | C:462-586,C:704-860 |
| P04035 | DB01076 | 117 | 1hwk | e1hwkD1 | D:587-703 |
| P04035 | DB01076 | 117 | 1hwk | e1hwkD2 | D:463-586,D:704-850 |