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Ligand · G3B

G3B · 2-methyl-5-(3-{4-[(S)-methylsulfinyl]phenyl}-1-benzofuran-5-yl)-1,3,4-oxadiazole

G3B, 2-methyl-5-(3-{4-[(S)-methylsulfinyl]phenyl}-1-benzofuran-5-yl)-1,3,4-oxadiazole (C18 H14 N2 O3 S, 338.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5…

Component
G3B
Formula
C18 H14 N2 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

G3B in 2 structures; the first of them:

  • 3GB2 · GSK3beta inhibitor complex · G3B A999 · binds ILE62, PHE67, VAL70, ALA83, LYS85, VAL110, LEU132, ASP133 and 8 more
  • 3GB2 · GSK3BETA inhibitor complex · G3B A999 · binds ILE62, PHE67, VAL70, ALA83, LYS85, VAL110, LEU132, ASP133 and 8 more

Residues it binds most

VAL 2, ASP 2, LEU 2, ALA 2, ARG 2, CYS 2, ILE 2, LYS 2, PHE 2, PRO 2 (residue and the binding sites it lines).

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