4iwv Summary details

pdbe.org/4iwv/summary_details
spacer Crystals structure of Human Glucokinase in complex with small molecule activator
Summary
Header TRANSFERASE/TRANSFERASE INHIBITORsearch
Method X-RAY DIFFRACTION
Experiment Resolution: 2.1 Å, R-factor: 20.165%, Free R-factor: 24.982%, Spacegroup: P 41
Released 24/04/2013, deposition: 24/01/2013, last revision: 24/04/2013
Authors Ogg, D.J.search; Hargreaves, D.search; Gerhardt, S.search; Flavell, L.search; McAlister, M.search
Primary citation Optimising pharmacokinetics of glucokinase activators with matched triplicate design sets the discovery of AZD3651 and AZD9485
To be Published
Keywords Allosteric Sitesearch, Catalysissearch, Enzyme Activationsearch, Gene Expression Regulationsearch, Glucokinasesearch, Glucosesearch, Homeostasissearch, Humanssearch, Hypoglycemiasearch, Kineticssearch, Biologicalsearch, Modelssearch, Molecularsearch, Mutationsearch, Protein Conformationsearch, Scatteringsearch, Radiationsearch, X-Rayssearch, TRANSFERASE-TRANSFERASE INHIBITOR complexsearch
EC 2.7.1.2 ExPASy BRENDA search (A)
Organism Homo sapiens(human) 9606search(A)
UniProt P35557search (A)
Solvent A
Polymers
Chain Id Name Type UniProt Residues in sample sequence % of sample sequence observed
A Glucokinase isoform 3 Protein P35557 (HXK4_HUMAN)search
456 97%
Heterogens
Chain Id Name Ligands
A SODIUM ION NA search
A SUGAR (ALPHA-D-GLUCOSE) GLC search
A (2S)-2-{[1-(2-CHLOROPHENYL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-YL]OXY}-N-(5-CHLOROPYRIDIN-2-YL)-3-(2-HYDROXYETHOXY)PROPANAMIDE 1J9 search
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