Attributes
UniProt ID
Protein Name
3-hydroxy-3-methylglutaryl-coenzyme A reductase
Ligand Name
(3S)-3-hydroxy-3-methyl-5-sulfanylpentanoic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
MCHPXVGJHBKMNR-ZCFIWIBFSA-N
SMILES
CC(CCS)(CC(=O)O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 4I4B
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Color Legend
Unassigned regionsLigand / hetero atomse4i4bA1e4i4bA2e4i4bA3e4i4bB1e4i4bB2
ECOD domains from experimental PDB structures interacting with ligand 1CO
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P13702 | n/a | 1CO | 4i4b | e4i4bA1 | A:111-220 |
| P13702 | n/a | 1CO | 4i4b | e4i4bA2 | A:3-110,A:221-385 |
| P13702 | n/a | 1CO | 4i4b | e4i4bB2 | B:503-610,B:721-878 |
| P13702 | n/a | 1CO | 4i6w | e4i6wA1 | A:111-220 |
| P13702 | n/a | 1CO | 4i6w | e4i6wA2 | A:3-110,A:221-375 |
| P13702 | n/a | 1CO | 4i6w | e4i6wB1 | B:611-720 |
| P13702 | n/a | 1CO | 4i6w | e4i6wB2 | B:503-610,B:721-878 |