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Ligand · SWT

SWT · 6-(4-methylphenyl)sulfanyl-2~{H}-[1,2,4]triazolo[4,3-b]pyridazin-3-one

SWT, 6-(4-methylphenyl)sulfanyl-2~{H}-[1,2,4]triazolo[4,3-b]pyridazin-3-one (C12 H10 N4 O S, 258.3 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…

Component
SWT
Formula
C12 H10 N4 O S
Class
ligand
Structures
2
PDB entries
1

Binding sites

SWT in 2 structures; the first of them:

  • 7B4X · Notum complex with ARUK3002697 · SWT A512 · binds GLY126, GLY127, TRP128, TYR129, VAL187, SER232, ALA233, THR236 and 5 more
  • 7B4X · Notum complex with ARUK3002697 · SWT A512 · binds GLY126, GLY127, TRP128, TYR129, VAL187, SER232, ALA233, THR236 and 5 more

Residues it binds most

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

Found with

  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide
  • EDO · 1,2-ethanediol

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