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Ligand · WFD

WFD · 1-[4-(4-{4-(4-methylpiperazin-1-yl)-6-[(3-methyl-1H-pyrazol-5-yl)amino]pyrimidin-2-yl}phenyl)piperidin-1-yl]prop-2-en-1-one

WFD, 1-[4-(4-{4-(4-methylpiperazin-1-yl)-6-[(3-methyl-1H-pyrazol-5-yl)amino]pyrimidin-2-yl}phenyl)piperidin-1-yl]prop-2-en-1-one (C27 H34 N8 O, 486.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
WFD
Formula
C27 H34 N8 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

WFD in 2 structures; the first of them:

  • 7KIA · Crystal structure of FGFR2 kinase domain gatekeeper mutant V564F in complex with covalent… · WFD A801 · binds LEU487, GLY488, GLU489, GLY490, CYS491, PHE492, VAL495, ALA515 and 12 more
  • 7KIA · Crystal structure of FGFR2 kinase domain gatekeeper mutant V564F in complex with covalent… · WFD A801 · binds LEU487, GLY488, GLU489, GLY490, CYS491, PHE492, VAL495, ALA515 and 9 more

Residues it binds most

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

Found with

  • NA · Sodium ion
  • FLC · Citrate anion

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