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Ligand · DYK

DYK · N-{2-methoxy-4-[(1-methylpiperidin-4-yl)oxy]phenyl}-4-(1H-pyrrolo[2,3-c]pyridin-3-yl)pyrimidin-2-amine

DYK, N-{2-methoxy-4-[(1-methylpiperidin-4-yl)oxy]phenyl}-4-(1H-pyrrolo[2,3-c]pyridin-3-yl)pyrimidin-2-amine (C24 H26 N6 O2, 430.5 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with…

Component
DYK
Formula
C24 H26 N6 O2
Class
ligand
Structures
4
PDB entries
2

Binding sites

DYK in 4 structures; the first of them:

  • 4D2R · Human IGF in complex with a Dyrk1B inhibitor · DYK A2288 · binds LEU1005, GLY1006, GLN1007, VAL1013, GLU1015, ALA1031, GLU1080, LEU1081 and 6 more
  • 4D2S · Human TTK in complex with a Dyrk1B inhibitor · DYK A1794 · binds LYS529, ILE531, VAL539, GLN541, ALA551, LYS553, ILE586, MET602 and 9 more
  • 4D2R · Human igf in complex with a DYRK1B inhibitor · DYK A2288 · binds LEU1005, GLY1006, GLN1007, VAL1013, GLU1015, ALA1031, GLU1080, LEU1081 and 6 more
  • 4D2S · Human ttk in complex with a DYRK1B inhibitor · DYK A1794 · binds LYS529, ILE531, VAL539, GLN541, ALA551, LYS553, ILE586, MET602 and 9 more

Residues it binds most

ILE 2, MET 4, GLU 4, GLY 4, LEU 4, ALA 4, GLN 4, LYS 2, VAL 4, ARG 2 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion

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