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Ligand · 2F4

2F4 · 2-{4-[(6,7-difluoro-1H-benzimidazol-2-yl)amino]phenoxy}-N-methyl-3,4'-bipyridin-2'-amine

2F4, 2-{4-[(6,7-difluoro-1H-benzimidazol-2-yl)amino]phenoxy}-N-methyl-3,4'-bipyridin-2'-amine (C24 H18 F2 N6 O, 444.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
2F4
Formula
C24 H18 F2 N6 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

2F4 in 2 structures; the first of them:

  • 4MUW · Crystal Structure of PDE10A with Novel Keto-Benzimidazole Inhibitor · 2F4 A1012 · binds TYR514, HIS515, LEU625, LEU665, SER667, VAL668, ILE682, TYR683 and 9 more
  • 4MUW · Crystal structure of PDE10A with novel keto-benzimidazole inhibitor · 2F4 A1012 · binds TYR514, HIS515, LEU625, LEU665, SER667, VAL668, ILE682, TYR683 and 9 more

Residues it binds most

LEU 4, PHE 4, TYR 4, VAL 4, GLN 4, GLU 4, GLY 4, HIS 4, ILE 4, LYS 4 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • SO4 · Sulfate ion
  • GOL · Glycerol

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