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Ligand · 15J

15J · (1-{3-[4-(1H-benzimidazol-2-ylamino)phenoxy]pyridin-2-yl}piperidin-4-yl)methanol

15J, (1-{3-[4-(1H-benzimidazol-2-ylamino)phenoxy]pyridin-2-yl}piperidin-4-yl)methanol (C24 H25 N5 O2, 415.5 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…

Component
15J
Formula
C24 H25 N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

15J in 2 structures; the first of them:

  • 4HEU · Crystal Structure of PDE10A with a biaryl ether inhibitor… · 15J A1009 · binds TYR514, LEU625, LEU665, SER667, VAL668, THR675, THR678, ALA679 and 11 more
  • 4HEU · Crystal structure of PDE10A with a biaryl ether inhibitor ((1-(3-(4… · 15J A1009 · binds TYR514, LEU625, LEU665, SER667, VAL668, THR675, THR678, ALA679 and 11 more

Residues it binds most

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

Found with

  • ZN · Zinc ion
  • SO4 · Sulfate ion

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