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Ligand · JPZ

JPZ · quinazolin-4(1H)-one

JPZ, quinazolin-4(1H)-one (C8 H6 N2 O, 146.2 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
JPZ
Formula
C8 H6 N2 O
Class
ligand
Structures
6
PDB entries
3

Binding sites

JPZ in 6 structures; the first of them:

  • 3NUY · phosphoinositide-dependent kinase-1 (PDK1) with fragment17 · JPZ A370 · binds LEU88, VAL96, ALA109, VAL143, LEU159, SER160, TYR161, ALA162 and 3 more
  • 4LM4 · Crystal structure of PDE10A2 with fragment ZT902 · JPZ A900 · binds TYR524, ASP674, LEU675, SER677, VAL678, ILE692, PHE696, GLN726 and 1 more
  • 4PNN · Crystal Structure of human Tankyrase 2 in complex with 4HQN. · JPZ A1202 · binds PHE1030, HIS1031, GLY1032, TYR1060, PHE1061, ALA1062, LYS1067, SER1068 and 2 more
  • 3NUY · Phosphoinositide-dependent kinase-1 (PDK1) with FRAGMENT17 · JPZ A370 · binds LEU88, VAL96, ALA109, VAL143, LEU159, SER160, TYR161, ALA162 and 3 more
  • 4LM4 · Crystal structure of PDE10A2 with fragment ZT902 · JPZ A900 · binds TYR524, ASP674, LEU675, SER677, VAL678, ILE692, PHE696, GLN726 and 1 more
  • 4PNN · Crystal structure of human tankyrase 2 in complex with 4HQN. · JPZ A1202 · binds PHE1030, HIS1031, GLY1032, TYR1060, PHE1061, ALA1062, LYS1067, SER1068 and 2 more

Residues it binds most

PHE 8, TYR 10, ALA 8, SER 10, LEU 4, GLU 6, GLY 6, HIS 6, LYS 6, VAL 4 (residue and the binding sites it lines).

Found with

  • NI · Nickel (II) ion
  • ZN · Zinc ion
  • SO4 · Sulfate ion
  • GOL · Glycerol

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