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Ligand · WXS

WXS · 4-methyl-5-{[(9H-purin-6-yl)sulfanyl]methyl}-2H-1,3-dioxol-2-one

WXS, 4-methyl-5-{[(9H-purin-6-yl)sulfanyl]methyl}-2H-1,3-dioxol-2-one (C10 H8 N4 O3 S, 264.3 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…

Component
WXS
Formula
C10 H8 N4 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

WXS in 2 structures; the first of them:

  • 5SOY · PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in… · WXS A201 · binds ALA21, ILE23, ALA38, GLY48, VAL49, ALA50, GLY130, ILE131 and 3 more
  • 5SOY · Pandda analysis group deposition -- crystal structure of SARS-cov-2 NSP3 macrodomain in… · WXS A201 · binds ALA21, ILE23, ALA38, GLY48, VAL49, ALA50, GLY130, ILE131 and 3 more

Residues it binds most

ALA 2, GLY 2, ILE 2, PHE 2, VAL 2 (residue and the binding sites it lines).

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