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Ligand · 31W

31W · 1-cyclopropyl-1-[3-(1,3-thiazol-2-yl)benzyl]-3-[4-(trifluoromethoxy)phenyl]urea

31W, 1-cyclopropyl-1-[3-(1,3-thiazol-2-yl)benzyl]-3-[4-(trifluoromethoxy)phenyl]urea (C21 H18 F3 N3 O2 S, 433.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
31W
Formula
C21 H18 F3 N3 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

31W in 2 structures; the first of them:

  • 4PMP · The structure of TrkA kinase bound to the inhibitor… · 31W A801 · binds LEU516, VAL524, ALA542, LYS544, LEU564, LEU567, ILE572, VAL573 and 13 more
  • 4PMP · The structure of trka kinase bound to the inhibitor 1-cyclopropyl-1… · 31W A801 · binds LEU516, VAL524, ALA542, LYS544, LEU564, LEU567, ILE572, VAL573 and 13 more

Residues it binds most

LEU 2, PHE 2, GLY 2, ILE 2, VAL 2, ALA 2, ASP 2, GLU 2, HIS 2, LYS 2 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion
  • ACT · Acetate ion

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