Attributes
UniProt ID
Protein Name
3-hydroxy-3-methylglutaryl-coenzyme A reductase
Ligand Name
(3R,5R)-7-[2-(4-fluorophenyl)-5-(1-methylethyl)-4-(morpholin-4-ylsulfonyl)-3-phenyl-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
XLVZRBHNHHAPDT-JWQCQUIFSA-N
SMILES
CC(C)c1c(c(c(n1CCC(CC(CC(=O)O)O)O)c2ccc(cc2)F)c3ccccc3)S(=O)(=O)N4CCOCC4
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 3BGL
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Color Legend
Unassigned regionsLigand / hetero atomse3bglA1e3bglA2e3bglB1e3bglB2e3bglC1e3bglC2e3bglD1e3bglD2
ECOD domains from experimental PDB structures interacting with ligand RID
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P04035 | n/a | RID | 3bgl | e3bglA1 | A:570-686 |
| P04035 | n/a | RID | 3bgl | e3bglA2 | A:441-569,A:687-861 |
| P04035 | n/a | RID | 3bgl | e3bglB1 | B:570-686 |
| P04035 | n/a | RID | 3bgl | e3bglB2 | B:441-569,B:687-861 |
| P04035 | n/a | RID | 3bgl | e3bglC1 | C:579-695 |
| P04035 | n/a | RID | 3bgl | e3bglC2 | C:444-578,C:696-860 |
| P04035 | n/a | RID | 3bgl | e3bglD1 | D:575-691 |
| P04035 | n/a | RID | 3bgl | e3bglD2 | D:442-574,D:692-859 |