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Ligand · 780

780 · 3-{5-[amino(iminio)methyl]-1H-benzimidazol-2-yl}-1,1'-biphenyl-2-olate

780, 3-{5-[amino(iminio)methyl]-1H-benzimidazol-2-yl}-1,1'-biphenyl-2-olate (C20 H16 N4 O, 328.4 g/mol), in the MolNFT structures on GenesisL1: bound in 10 records (5 PDB entries). Every binding site with its residues within 4.5 Å, the…

Component
780
Formula
C20 H16 N4 O
Class
ligand
Structures
10
PDB entries
5

Binding sites

780 in 10 structures; the first of them:

  • 1O39 · Elaborate Manifold of Short Hydrogen Bond Arrays Mediating Binding of Active… · 780 A246 · binds PHE41, CYS42, HIS57, ASP189, SER190, CYS191, GLN192, SER195 and 9 more
  • 1O3A · Elaborate Manifold of Short Hydrogen Bond Arrays Mediating Binding of Active… · 780 A246 · binds PHE41, CYS42, HIS57, CYS58, ASP189, SER190, CYS191, GLN192 and 10 more
  • 1O3B · Elaborate Manifold of Short Hydrogen Bond Arrays Mediating Binding of Active… · 780 A246 · binds PHE41, CYS42, HIS57, CYS58, ASP189, SER190, CYS191, GLN192 and 10 more
  • 1O3C · Elaborate Manifold of Short Hydrogen Bond Arrays Mediating Binding of Active… · 780 A246 · binds PHE41, CYS42, HIS57, CYS58, ASP189, SER190, CYS191, GLN192 and 9 more
  • 1O3D · Elaborate Manifold of Short Hydrogen Bond Arrays Mediating Binding of Active… · 780 A246 · binds PHE41, CYS42, HIS57, CYS58, ASP189, SER190, CYS191, GLN192 and 10 more
  • 1O39 · Elaborate manifold of short hydrogen bond arrays mediating binding of active… · 780 A246 · binds PHE41, CYS42, HIS57, ASP189, SER190, CYS191, GLN192, SER195 and 9 more
  • 1O3A · Elaborate manifold of short hydrogen bond arrays mediating binding of active… · 780 A246 · binds PHE41, CYS42, HIS57, CYS58, ASP189, SER190, CYS191, GLN192 and 10 more
  • 1O3B · Elaborate manifold of short hydrogen bond arrays mediating binding of active… · 780 A246 · binds PHE41, CYS42, HIS57, CYS58, ASP189, SER190, CYS191, GLN192 and 10 more
  • 1O3C · Elaborate manifold of short hydrogen bond arrays mediating binding of active… · 780 A246 · binds PHE41, CYS42, HIS57, CYS58, ASP189, SER190, CYS191, GLN192 and 9 more
  • 1O3D · Elaborate manifold of short hydrogen bond arrays mediating binding of active… · 780 A246 · binds PHE41, CYS42, HIS57, CYS58, ASP189, SER190, CYS191, GLN192 and 10 more

Residues it binds most

CYS 10, SER 10, GLY 10, ASP 10, GLN 10, HIS 10, PHE 10, TRP 10, TYR 10, VAL 10 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • CL · Chloride ion

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