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Ligand · WIQ

WIQ · 3-[(6-chloro-1-cyclopropyl-1H-benzimidazol-5-yl)ethynyl]-1-[(3S,5S)-5-(methoxymethyl)-1-(prop-2-enoyl)pyrrolidin-3-yl]-5-(methylamino)-1H-pyrazole-4-carboxamide

WIQ, 3-[(6-chloro-1-cyclopropyl-1H-benzimidazol-5-yl)ethynyl]-1-[(3S,5S)-5-(methoxymethyl)-1-(prop-2-enoyl)pyrrolidin-3-yl]-5-(methylamino)-1H-pyrazole-4-carboxamide (C26 H30 Cl N7 O3, 524.0 g/mol), in the MolNFT structures on GenesisL1…

Component
WIQ
Formula
C26 H30 Cl N7 O3
Class
ligand
Structures
2
PDB entries
2

Binding sites

WIQ in 2 structures; the first of them:

  • 8UDU · The X-RAY co-crystal structure of human FGFR3 and Compound 17 · WIQ A1002 · binds LEU478, GLY479, GLU480, CYS482, PHE483, VAL486, ALA506, LYS508 and 14 more
  • 8UDV · The X-RAY co-crystal structure of human FGFR3 V555M and Compound 17 · WIQ A1003 · binds LEU478, GLY479, GLU480, GLY481, CYS482, PHE483, VAL486, ALA506 and 17 more

Residues it binds most

GLU 5, ALA 5, LEU 5, GLY 5, VAL 5, PHE 5, MET 5, ASN 5, ASP 5, CYS 5 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion
  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol

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