Crystal structure of glucokinase (hexokinase 4) complexed with ligand diethyl ({2-[3-(4-methanesulfonylpheno xy)-5-{[(2S)-1-methoxypropan- 2-YL]OXY}BENZAMIDO]-1,3-thiaz ol-4-YL}METHYL)PHOSPHONATE

Structure

x-ray diffraction · 2 distinct chains.

Ligands and binding sites

• G2T · diethyl {[2-(3-[4-(methanesulfonyl)phenoxy]-5-{[(2S)-1-methoxypropan-2-yl]oxy}benzamido)-1,3-thiazol-4-yl]methyl}phosphonate · ligand · 2 copies · chains A, B
• GLC · alpha-D-glucopyranose · sugar · 2 copies · chains A, B
• NA · Sodium ion · metal · 2 copies · chains A, B
• EDO · 1,2-ethanediol · additive · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

• 7T78 · Crystal structure of glucokinase (hexokinase 4) complexed with ligand diethyl… · the same entry in another collection · chain A against A, TM-score 1.00
• P35557 · AlphaFold monomer V2.0 prediction for hexokinase-4 (P35557) · a predicted model of the same protein · chain A against A, TM-score 0.99

Analyse

• Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
• Every structure of UniProt P35557
• Elsewhere: RCSB PDB 7T78 · PDBe 7T78 · UniProt P35557