Attributes
UniProt ID
Protein Name
Acetylcholinesterase
Ligand Name
4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM-1-YL}METHOXY)METHYL]PYRIDINIUM
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
FJZDLOMCEPUCII-UHFFFAOYSA-P
SMILES
c1cc[n+](c(c1)C=NO)COC[n+]2ccc(cc2)C(=O)N
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 2GYU
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Color Legend
Unassigned regionsLigand / hetero atomse2gyuA1e2gyuB1
ECOD domains from experimental PDB structures interacting with ligand HI6
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P21836 | n/a | HI6 | 2gyu | e2gyuA1 | A:6-542 |
| P21836 | n/a | HI6 | 2gyu | e2gyuB1 | B:6-542 |
| P21836 | n/a | HI6 | 2whp | e2whpA1 | A:1-542 |
| P21836 | n/a | HI6 | 2whp | e2whpB1 | B:4-542 |
| P21836 | n/a | HI6 | 2whq | e2whqA1 | A:1-542 |
| P21836 | n/a | HI6 | 2whq | e2whqB1 | B:4-544 |
| P21836 | n/a | HI6 | 2wu3 | e2wu3A1 | A:1-546 |
| P21836 | n/a | HI6 | 2wu3 | e2wu3B1 | B:4-543 |
| P21836 | n/a | HI6 | 3zlv | e3zlvA1 | A:4-535 |
| P21836 | n/a | HI6 | 3zlv | e3zlvB1 | B:4-535 |
| P21836 | n/a | HI6 | 5fpp | e5fppA1 | A:1-548 |
| P21836 | n/a | HI6 | 5fpp | e5fppB1 | B:5-544 |