Attributes
UniProt ID
Protein Name
Soluble acetylcholine receptor
Ligand Name
(4R)-2-METHYLPENTANE-2,4-DIOL
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
SVTBMSDMJJWYQN-RXMQYKEDSA-N
SMILES
CC(CC(C)(C)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: 3SH1
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 atomse3sh1A1e3sh1B1e3sh1C1e3sh1D1e3sh1E1e3sh1F1e3sh1G1e3sh1H1e3sh1I1e3sh1J1
ECOD domains from experimental PDB structures interacting with ligand MRD
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q8WSF8 | n/a | MRD | 3sh1 | e3sh1A1 | A:-5-208 |
| Q8WSF8 | n/a | MRD | 3sh1 | e3sh1B1 | B:-6-208 |
| Q8WSF8 | n/a | MRD | 3sh1 | e3sh1C1 | C:-6-209 |
| Q8WSF8 | n/a | MRD | 3sh1 | e3sh1D1 | D:-6-207 |
| Q8WSF8 | n/a | MRD | 3sh1 | e3sh1E1 | E:-6-208 |
| Q8WSF8 | n/a | MRD | 3sh1 | e3sh1F1 | F:-6-207 |
| Q8WSF8 | n/a | MRD | 3sh1 | e3sh1J1 | J:-6-208 |
| Q8WSF8 | n/a | MRD | 3sio | e3sioA1 | A:-6-207 |
| Q8WSF8 | n/a | MRD | 3sio | e3sioB1 | B:-8-207 |
| Q8WSF8 | n/a | MRD | 3sio | e3sioC1 | C:-4-216 |
| Q8WSF8 | n/a | MRD | 3sio | e3sioD1 | D:-5-208 |
| Q8WSF8 | n/a | MRD | 3sio | e3sioE1 | E:-8-207 |
| Q8WSF8 | n/a | MRD | 3sio | e3sioF1 | F:-6-207 |
| Q8WSF8 | n/a | MRD | 3sio | e3sioG1 | G:-8-207 |
| Q8WSF8 | n/a | MRD | 3sio | e3sioH1 | H:-4-216 |
| Q8WSF8 | n/a | MRD | 3sio | e3sioI1 | I:-5-208 |
| Q8WSF8 | n/a | MRD | 3sio | e3sioJ1 | J:-8-207 |
| Q8WSF8 | n/a | MRD | 3t4m | e3t4mA1 | A:-6-207 |
| Q8WSF8 | n/a | MRD | 3t4m | e3t4mB1 | B:-6-207 |
| Q8WSF8 | n/a | MRD | 3t4m | e3t4mC1 | C:-4-209 |
| Q8WSF8 | n/a | MRD | 3t4m | e3t4mD1 | D:-6-208 |
| Q8WSF8 | n/a | MRD | 3t4m | e3t4mE1 | E:-6-207 |
| Q8WSF8 | n/a | MRD | 3t4m | e3t4mF1 | F:-6-207 |
| Q8WSF8 | n/a | MRD | 3t4m | e3t4mG1 | G:-7-207 |
| Q8WSF8 | n/a | MRD | 3t4m | e3t4mH1 | H:-6-208 |
| Q8WSF8 | n/a | MRD | 3t4m | e3t4mI1 | I:-5-209 |
| Q8WSF8 | n/a | MRD | 3t4m | e3t4mJ1 | J:-5-207 |