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Ligand · 2W1

2W1 · 1H-benzimidazol-2-yl(4-{[3-(tetrahydro-2H-pyran-4-yl)pyridin-2-yl]oxy}phenyl)methanone

2W1, 1H-benzimidazol-2-yl(4-{[3-(tetrahydro-2H-pyran-4-yl)pyridin-2-yl]oxy}phenyl)methanone (C24 H21 N3 O3, 399.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
2W1
Formula
C24 H21 N3 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

2W1 in 2 structures; the first of them:

  • 4PHW · Crystal Structure of PDE10A with 1H-benzimidazol-2-yl(4-((3-(tetrahydro-2H-pyran-4-yl)-2-p… · 2W1 A805 · binds TYR514, HIS515, LEU625, LEU665, SER667, VAL668, ILE682, TYR683 and 9 more
  • 4PHW · Crystal structure of PDE10A with 1H-benzimidazol-2-YL(4-((3… · 2W1 A805 · 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

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