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Ligand · 2TF

2TF · (2S)-2-{4-[(2S)-4-[(6-aminopyridin-3-yl)sulfonyl]-2-(prop-1-yn-1-yl)piperazin-1-yl]phenyl}-3,3,3-trifluoropropane-1,2-diol

2TF, (2S)-2-{4-[(2S)-4-[(6-aminopyridin-3-yl)sulfonyl]-2-(prop-1-yn-1-yl)piperazin-1-yl]phenyl}-3,3,3-trifluoropropane-1,2-diol (C21 H23 F3 N4 O4 S, 484.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
2TF
Formula
C21 H23 F3 N4 O4 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

2TF in 2 structures; the first of them:

  • 4OHM · Human GKRP bound to AMG-0771 and sorbitol-6-phosphate · 2TF A701 · binds VAL10, TYR24, VAL28, PRO29, GLU32, LYS33, SER34, GLY181 and 17 more
  • 4OHM · Human gkrp bound to amg-0771 and sorbitol-6-phosphate · 2TF 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, ASN 4, ASP 4, GLN 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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