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Ligand · TGI

TGI · Tiagabine

TGI, Tiagabine (C20 H25 N O2 S2, 375.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
TGI
Formula
C20 H25 N O2 S2
Class
ligand
Structures
2
PDB entries
2

Binding sites

TGI in 2 structures; the first of them:

  • 7Y7Z · Cryo-EM structure of human GABA transporter GAT1 bound with tiagabine in NaCl solution in… · TGI A701 · binds GLY59, TYR60, ALA61, ILE62, GLY63, LEU64, GLY65, TYR140 and 11 more
  • 7SK2 · Human wildtype GABA reuptake transporter 1 in complex with tiagabine, inward-open… · TGI A601 · binds TYR60, GLY63, LEU64, GLY65, PHE98, TYR140, PHE294, SER295 and 9 more

Residues it binds most

LEU 2, GLY 2, SER 2, TYR 2, PHE 2, ALA 2, CYS 2, ASP 1, ILE 1, THR 1 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • CL · Chloride ion

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