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Ligand · 2TG

2TG · 5-{[(3S)-3-(prop-1-yn-1-yl)-4-{4-[S-(trifluoromethyl)sulfonimidoyl]phenyl}piperazin-1-yl]sulfonyl}pyridin-2-amine

2TG, 5-{[(3S)-3-(prop-1-yn-1-yl)-4-{4-[S-(trifluoromethyl)sulfonimidoyl]phenyl}piperazin-1-yl]sulfonyl}pyridin-2-amine (C19 H20 F3 N5 O3 S2, 487.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
2TG
Formula
C19 H20 F3 N5 O3 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

2TG in 2 structures; the first of them:

  • 4OHO · Human GKRP bound to AMG-2668 · 2TG A701 · binds VAL10, TYR24, VAL28, PRO29, GLU32, LYS33, SER34, GLY181 and 17 more
  • 4OHO · Human gkrp bound to amg-2668 · 2TG A701 · binds VAL10, TYR24, VAL28, PRO29, GLU32, LYS33, SER34, GLY181 and 17 more

Residues it binds most

ARG 4, SER 4, ALA 4, LEU 4, LYS 4, MET 4, VAL 4, GLU 4, ASN 4, ASP 4 (residue and the binding sites it lines).

Found with

  • S6P · D-sorbitol-6-phosphate
  • IOD · Iodide ion
  • SO4 · Sulfate ion
  • GOL · Glycerol

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