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Ligand · A2E

A2E · (5S)-5-{[10-(1,2,3,4-tetrahydroacridin-9-ylamino)decyl]amino}-5,6,7,8-tetrahydroquinolin-2(1H)-one

A2E, (5S)-5-{[10-(1,2,3,4-tetrahydroacridin-9-ylamino)decyl]amino}-5,6,7,8-tetrahydroquinolin-2(1H)-one (C32 H44 N4 O, 500.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
A2E
Formula
C32 H44 N4 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

A2E in 2 structures; the first of them:

  • 1ZGC · Crystal Structure of Torpedo Californica Acetylcholinesterase in Complex With an… · A2E A1002 · binds TYR70, ASP72, GLY80, TRP84, GLY117, GLY118, TYR121, GLU199 and 15 more
  • 1ZGC · Crystal structure of torpedo californica acetylcholinesterase in complex with an… · A2E A1002 · binds TYR70, ASP72, GLY80, TRP84, GLY117, GLY118, TYR121, GLU199 and 15 more

Residues it binds most

GLY 4, TYR 4, PHE 4, TRP 4, ILE 4, SER 4, ASP 4, GLU 4, HIS 4, LEU 4 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose

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