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Ligand · QK5

QK5 · (3-{(3R)-1-[4-(1-benzothiophen-2-yl)pyrimidin-2-yl]piperidin-3-yl}-2-methyl-1H-pyrrolo[2,3-b]pyridin-1-yl)acetonitrile

QK5, (3-{(3R)-1-[4-(1-benzothiophen-2-yl)pyrimidin-2-yl]piperidin-3-yl}-2-methyl-1H-pyrrolo[2,3-b]pyridin-1-yl)acetonitrile (C27 H24 N6 S, 464.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
QK5
Formula
C27 H24 N6 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

QK5 in 2 structures; the first of them:

  • 3QK5 · Crystal structure of fatty acid amide hydrolase with small molecule inhibitor · QK5 A600 · binds MET191, LEU192, SER193, PHE194, GLY216, ILE238, GLY239, GLY240 and 15 more
  • 3QK5 · Crystal structure of fatty acid amide hydrolase with small molecule inhibitor · QK5 A600 · binds MET191, LEU192, SER193, PHE194, GLY216, ILE238, GLY239, GLY240 and 15 more

Residues it binds most

LEU 4, GLY 4, PHE 4, ILE 4, MET 4, SER 4, THR 4, TRP 4 (residue and the binding sites it lines).

Found with

  • EDO · 1,2-ethanediol
  • GOL · Glycerol

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