Attributes
UniProt ID
Protein Name
Acetylcholine-binding protein
Ligand Name
3-[(2S)-pyrrolidin-2-ylethynyl]pyridine
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
YOOCTKCKTOXZCT-NSHDSACASA-N
SMILES
c1cc(cnc1)C#CC2CCCN2
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 4ZRU
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Color Legend
Unassigned regionsLigand / hetero atomse4zruA1e4zruB1e4zruC1e4zruD1e4zruE1e4zruF1e4zruG1e4zruH1e4zruI1e4zruJ1
ECOD domains from experimental PDB structures interacting with ligand TI9
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P58154 | n/a | TI9 | 4zru | e4zruA1 | A:-7-204 |
| P58154 | n/a | TI9 | 4zru | e4zruB1 | B:-3-205 |
| P58154 | n/a | TI9 | 4zru | e4zruC1 | C:2-204 |
| P58154 | n/a | TI9 | 4zru | e4zruD1 | D:0-205 |
| P58154 | n/a | TI9 | 4zru | e4zruE1 | E:1-204 |
| P58154 | n/a | TI9 | 4zru | e4zruF1 | F:-5-205 |
| P58154 | n/a | TI9 | 4zru | e4zruG1 | G:-3-204 |
| P58154 | n/a | TI9 | 4zru | e4zruH1 | H:0-203 |
| P58154 | n/a | TI9 | 4zru | e4zruI1 | I:0-204 |
| P58154 | n/a | TI9 | 4zru | e4zruJ1 | J:-1-204 |