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Ligand · E12

E12 · (S,S)-(-)-N,N'-di-5'-[5',6',7',8'-tetrahydro- 2'(1'H)-quinolynyl]-1,12-diaminododecane dihydrochloride

E12, (S,S)-(-)-N,N'-di-5'-[5',6',7',8'-tetrahydro- 2'(1'H)-quinolynyl]-1,12-diaminododecane dihydrochloride (C30 H46 N4 O2, 494.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
E12
Formula
C30 H46 N4 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

E12 in 2 structures; the first of them:

  • 1H23 · Structure of acetylcholinesterase (E.C. 3.1.1.7) complexed with… · E12 A1536 · binds TYR70, TRP84, TYR116, GLY117, GLY118, TYR121, SER122, GLY123 and 14 more
  • 1H23 · Structure of acetylcholinesterase (E.C. 3.1.1.7) complexed with (S,S)… · E12 A1536 · binds TYR70, TRP84, TYR116, GLY117, GLY118, TYR121, SER122, GLY123 and 14 more

Residues it binds most

GLY 2, TYR 2, PHE 2, ILE 2, SER 2, TRP 2, GLU 2, HIS 2, LEU 2 (residue and the binding sites it lines).

Found with

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

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