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Ligand · QYB

QYB · 3-phenyl-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one

QYB, 3-phenyl-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one (C11 H8 N4 O, 212.2 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, the residues it binds most and…

Component
QYB
Formula
C11 H8 N4 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

QYB in 2 structures; the first of them:

  • 7A52 · Structure of DYRK1A in complex with compound 6 · QYB A501 · binds ILE165, VAL173, ALA186, LYS188, GLU203, VAL222, PHE238, GLU239 and 6 more
  • 7A52 · Structure of DYRK1A in complex with compound 6 · QYB A501 · binds ILE165, VAL173, ALA186, LYS188, GLU203, VAL222, PHE238, GLU239 and 6 more

Residues it binds most

VAL 4, LEU 4, GLU 4, ALA 4, ASP 4, ILE 4, LYS 4, MET 4, PHE 4, SER 4 (residue and the binding sites it lines).

Found with

  • PO4 · Phosphate ion
  • DMS · Dimethyl sulfoxide

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