Attributes
UniProt ID
Protein Name
3-hydroxy-3-methylglutaryl-coenzyme A reductase
Ligand Name
(3R,5R)-7-[1-(4-FLUOROPHENYL)-3-ISOPROPYL-4-OXO-5-PHENYL-4,5-DIHYDRO-3H-PYRROLO[2,3-C]QUINOLIN-2-YL]-3,5-DIHYDROXYHEPTANOIC ACID
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
UFHOPRVARZPTSH-JWQCQUIFSA-N
SMILES
CC(C)n1c(c(c-2c1C(=O)N(c3c2cccc3)c4ccccc4)c5ccc(cc5)F)CCC(CC(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: 2Q6C
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 atomse2q6cA1e2q6cA2e2q6cB1e2q6cB2e2q6cC1e2q6cC2e2q6cD1e2q6cD2
ECOD domains from experimental PDB structures interacting with ligand HR1
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P04035 | n/a | HR1 | 2q6c | e2q6cA1 | A:441-578,A:696-861 |
| P04035 | n/a | HR1 | 2q6c | e2q6cA2 | A:579-695 |
| P04035 | n/a | HR1 | 2q6c | e2q6cB1 | B:570-686 |
| P04035 | n/a | HR1 | 2q6c | e2q6cB2 | B:441-569,B:687-860 |
| P04035 | n/a | HR1 | 2q6c | e2q6cC1 | C:579-695 |
| P04035 | n/a | HR1 | 2q6c | e2q6cC2 | C:444-578,C:696-860 |
| P04035 | n/a | HR1 | 2q6c | e2q6cD1 | D:570-686 |
| P04035 | n/a | HR1 | 2q6c | e2q6cD2 | D:442-569,D:687-861 |