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Ligand · G1S

G1S · diethyl {[3-(3-{[5-(azetidine-1-carbonyl)pyrazin-2-yl]oxy}-5-[(propan-2-yl)oxy]benzamido)-1H-pyrazol-1-yl]methyl}phosphonate

G1S, diethyl {[3-(3-{[5-(azetidine-1-carbonyl)pyrazin-2-yl]oxy}-5-[(propan-2-yl)oxy]benzamido)-1H-pyrazol-1-yl]methyl}phosphonate (C26 H33 N6 O7 P, 572.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
G1S
Formula
C26 H33 N6 O7 P
Class
ligand
Structures
2
PDB entries
1

Binding sites

G1S in 2 structures; the first of them:

  • 7T79 · Crystal structure of glucokinase (hexokinase 4) complexed with ligand aka diethyl… · G1S A501 · binds TYR61, VAL62, ARG63, SER64, THR65, PRO66, GLY68, SER69 and 16 more
  • 7T79 · Crystal structure of glucokinase (hexokinase 4) complexed with ligand aka diethyl… · G1S A501 · binds TYR61, VAL62, ARG63, SER64, THR65, GLY68, SER69, VAL91 and 13 more

Residues it binds most

VAL 4, TYR 4, ILE 4, MET 4, SER 4, ALA 4, ARG 4, CYS 4, GLY 4, LEU 4 (residue and the binding sites it lines).

Found with

  • GLC · alpha-D-glucopyranose

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