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Ligand · TK1

TK1 · 1-({5-[4-(methylsulfonyl)phenoxy]-2-pyridin-2-yl-1H-benzimidazol-6-yl}methyl)pyrrolidine-2,5-dione

TK1, 1-({5-[4-(methylsulfonyl)phenoxy]-2-pyridin-2-yl-1H-benzimidazol-6-yl}methyl)pyrrolidine-2,5-dione (C24 H20 N4 O5 S, 476.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
TK1
Formula
C24 H20 N4 O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

TK1 in 2 structures; the first of them:

  • 3H1V · Human glucokinase in complex with a synthetic activator · TK1 X501 · binds TYR61, VAL62, ARG63, SER64, THR65, GLU96, GLY97, GLN98 and 13 more
  • 3H1V · Human glucokinase in complex with a synthetic activator · TK1 X501 · binds TYR61, VAL62, ARG63, SER64, THR65, GLU96, GLY97, GLN98 and 13 more

Residues it binds most

TYR 2, VAL 2, GLU 2, ILE 2, MET 2, ALA 2, ARG 2, CYS 2, GLN 2, GLY 2 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • GLC · alpha-D-glucopyranose

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