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Ligand · OBI

OBI · 1,1'-(oxydimethylene)bis(4-formylpyridinium)dioxime

OBI, 1,1'-(oxydimethylene)bis(4-formylpyridinium)dioxime (C14 H16 N4 O3 +2, 288.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
OBI
Formula
C14 H16 N4 O3 +2
Class
ligand
Structures
2
PDB entries
1

Binding sites

OBI in 2 structures; the first of them:

  • 2GYW · Crystal Structure of Mus musculus Acetylcholinesterase in Complex with Obidoxime · OBI A952 · binds TYR72, ASP74, TYR124, VAL282, GLU285, TRP286, TYR337, PHE338 and 2 more
  • 2GYW · Crystal structure of mus musculus acetylcholinesterase in complex with obidoxime · OBI A952 · binds TYR72, ASP74, TYR124, VAL282, GLU285, TRP286, TYR337, PHE338 and 2 more

Residues it binds most

TYR 4, ASP 4, GLU 4, HIS 4, PHE 4, TRP 4, VAL 4 (residue and the binding sites it lines).

Found with

  • FUC · alpha-L-fucopyranose
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • CO3 · Carbonate ion
  • P6G · Hexaethylene glycol

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