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Ligand · QYK

QYK · 4-azanyl-6-bromanyl-7-methyl-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

QYK, 4-azanyl-6-bromanyl-7-methyl-pyrrolo[2,3-d]pyrimidine-5-carbonitrile (C8 H6 Br N5, 252.1 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…

Component
QYK
Formula
C8 H6 Br N5
Class
ligand
Structures
2
PDB entries
1

Binding sites

QYK in 2 structures; the first of them:

  • 7A51 · Structure of DYRK1A in complex with compound 5 · QYK A501 · binds ILE165, VAL173, ALA186, VAL222, PHE238, GLU239, MET240, LEU241 and 3 more
  • 7A51 · Structure of DYRK1A in complex with compound 5 · QYK A501 · binds ILE165, VAL173, ALA186, VAL222, PHE238, GLU239, MET240, LEU241 and 3 more

Residues it binds most

VAL 2, LEU 2, ALA 2, GLU 2, ILE 2, MET 2, PHE 2, SER 2 (residue and the binding sites it lines).

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