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Ligand · WVI

WVI · 3-methyl-4-(thiophen-2-yl)-1H-pyrazol-5-amine

WVI, 3-methyl-4-(thiophen-2-yl)-1H-pyrazol-5-amine (C8 H9 N3 S, 179.2 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, the residues it binds most and the…

Component
WVI
Formula
C8 H9 N3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

WVI in 2 structures; the first of them:

  • 4BDH · Fragment-based screening identifies a new area for inhibitor binding to checkpoint kinase… · WVI A1514 · binds LEU226, VAL234, ALA247, LEU301, GLU302, LEU303, MET304, GLU308 and 2 more
  • 4BDH · Fragment-based screening identifies a new area for inhibitor binding to checkpoint kinase… · WVI A1514 · binds LEU226, VAL234, ALA247, LEU301, GLU302, LEU303, MET304, GLU308 and 2 more

Residues it binds most

LEU 2, GLU 2, ALA 2, MET 2, THR 2, VAL 2 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion
  • NO3 · Nitrate ion
  • EDO · 1,2-ethanediol

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