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Ligand · WEJ

WEJ · 4,5-dimethyl-N-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazole-3-carboxamide

WEJ, 4,5-dimethyl-N-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazole-3-carboxamide (C19 H17 N5 O, 331.4 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…

Component
WEJ
Formula
C19 H17 N5 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

WEJ in 2 structures; the first of them:

  • 7KHK · Crystal structure of KIT kinase domain with a small molecule inhibitor, PLX9486… · WEJ A1001 · binds LEU595, VAL603, ALA621, LYS623, GLU640, LEU644, VAL654, VAL668 and 10 more
  • 7KHK · Crystal structure of kit kinase domain with a small molecule inhibitor, PLX9486… · WEJ A1001 · binds LEU595, VAL603, ALA621, LYS623, GLU640, LEU644, VAL654, VAL668 and 10 more

Residues it binds most

CYS 4, LEU 4, VAL 4, GLU 4, TYR 4, ALA 4, ASP 4, GLY 4, LYS 4, THR 4 (residue and the binding sites it lines).

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