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Ligand · 656

656 · 2-{5-[amino(iminio)methyl]-1H-benzimidazol-2-yl}-6-isobutoxybenzenolate

656, 2-{5-[amino(iminio)methyl]-1H-benzimidazol-2-yl}-6-isobutoxybenzenolate (C18 H20 N4 O2, 324.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the…

Component
656
Formula
C18 H20 N4 O2
Class
ligand
Structures
2
PDB entries
2

Binding sites

656 in 2 structures; the first of them:

  • 1O2J · Elaborate Manifold of Short Hydrogen Bond Arrays Mediating Binding of Active… · 656 A246 · binds PHE41, CYS42, HIS57, CYS58, ASP189, SER190, CYS191, GLN192 and 10 more
  • 1O2K · Elaborate Manifold of Short Hydrogen Bond Arrays Mediating Binding of Active… · 656 A246 · binds PHE41, CYS42, HIS57, CYS58, ASP189, SER190, CYS191, GLN192 and 10 more

Residues it binds most

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

Found with

  • CA · Calcium ion
  • CL · Chloride ion
  • SO4 · Sulfate ion

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