Attributes
UniProt ID
Protein Name
Acetylcholinesterase
Ligand Name
3,8-DIAMINO-6-PHENYL-5-[6-[1-[2-[(1,2,3,4-TETRAHYDRO-9-ACRIDINYL)AMINO]ETHYL]-1H-1,2,3-TRIAZOL-5-YL]HEXYL]-PHENANTHRIDINIUM
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
ISUOMOOYAOQQPZ-UHFFFAOYSA-O
SMILES
c1ccc(cc1)c2c3cc(ccc3c4ccc(cc4[n+]2CCCCCCc5cnnn5CCNc6c7ccccc7nc8c6CCCC8)N)N
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 1Q83
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Color Legend
Unassigned regionsLigand / hetero atomse1q83A1e1q83B1
ECOD domains from experimental PDB structures interacting with ligand DB03005
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P21836 | DB03005 | TZ5 | 1q83 | e1q83A1 | A:6-541 |
| P21836 | DB03005 | TZ5 | 1q83 | e1q83B1 | B:6-540 |
| P21836 | DB03005 | TZ5 | 2xui | e2xuiA1 | A:1-541 |
| P21836 | DB03005 | TZ5 | 2xui | e2xuiB1 | B:4-541 |
| P21836 | DB03005 | TZ5 | 2xuj | e2xujA1 | A:1-542 |
| P21836 | DB03005 | TZ5 | 2xuj | e2xujB1 | B:4-541 |
| P21836 | DB03005 | TZ5 | 2xuk | e2xukA1 | A:1-542 |
| P21836 | DB03005 | TZ5 | 2xuk | e2xukB1 | B:4-542 |
| P21836 | DB03005 | TZ5 | 2xup | e2xupA1 | A:1-543 |
| P21836 | DB03005 | TZ5 | 2xup | e2xupB1 | B:4-543 |