GL1X · GenesisL1 explorer

Ligand · G3X

G3X · (4aS,6R,8aS)-3-methoxy-11-(3-piperidin-1-ylpropyl)-5,6,9,10,11,12-hexahydro-4aH-[1]benzofuro[3a,3,2-ef][2]benzazepin-6-ol

G3X, (4aS,6R,8aS)-3-methoxy-11-(3-piperidin-1-ylpropyl)-5,6,9,10,11,12-hexahydro-4aH-[1]benzofuro[3a,3,2-ef][2]benzazepin-6-ol (C24 H34 N2 O3, 398.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
G3X
Formula
C24 H34 N2 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

G3X in 2 structures; the first of them:

  • 3I6M · 3D Structure of Torpedo californica acetylcholinesterase complexed with… · G3X A1 · binds ASP72, TRP84, GLY117, GLY118, GLY119, TYR121, SER122, TYR130 and 10 more
  • 3I6M · 3D structure of torpedo californica acetylcholinesterase complexed with… · G3X A1 · binds ASP72, TRP84, GLY117, GLY118, GLY119, TYR121, SER122, TYR130 and 10 more

Residues it binds most

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

Found with

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

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