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Ligand · HUX

HUX · 3-chloro-9-ethyl-6,7,8,9,10,11-hexahydro-7,11-methanocycloocta[b]quinolin-12-amine

HUX, 3-chloro-9-ethyl-6,7,8,9,10,11-hexahydro-7,11-methanocycloocta[b]quinolin-12-amine (C18 H19 Cl N2, 298.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5…

Component
HUX
Formula
C18 H19 Cl N2
Class
ligand
Structures
2
PDB entries
1

Binding sites

HUX in 2 structures; the first of them:

  • 1E66 · Structure of acetylcholinesterase complexed with (-)-huprine X at 2.1A resolution · HUX A803 · binds ASP72, GLY80, TRP84, GLY117, GLY118, GLY119, TYR121, SER122 and 13 more
  • 1E66 · Structure of acetylcholinesterase complexed with (-)-huprine X at 2.1A resolution · HUX A803 · binds ASP72, GLY80, TRP84, GLY117, GLY118, GLY119, TYR121, SER122 and 13 more

Residues it binds most

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

Found with

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

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