Spectroscopic and computational studies of α-keto acid binding to Dke1: Understanding the role of the facial triad and the reactivity of β-diketones

Journal of the American Chemical Society

Volumn 133, Issue 40, 2011, Pages 15979-15991

  Diebold, Adrienne R ^a   Straganz, Grit D ^c   Solomon, Edward I ^a,b  

^a STANFORD UNIVERSITY   (United States)

^b SLAC NATIONAL ACCELERATOR LABORATORY   (United States)

^c GRAZ UNIVERSITY OF TECHNOLOGY   (Austria)

Author keywords

[No Author keywords available]

Indexed keywords

ACTIVE SITE; COMPUTATIONAL STUDIES; DFT CALCULATION; DIANIONS; DIKETONES; DIOXYGENASES; DIOXYGENS; ENOLATES; KETO ACIDS; MONOANIONS; NON-HEME IRON ENZYMES; NONHEME; REACTION MECHANISM; RESONANCE RAMAN; SPECTROSCOPIC STUDIES; UV-VIS ABSORPTIONS;

AMINO ACIDS; CARBOXYLATION; CHEMICAL ACTIVATION; KETONES; SPECTROSCOPIC ANALYSIS;

ENZYMES;

1,3 DIKETONE; 2 OXOACID; CARBOXYLIC ACID; DIOXYGENASE; DKE 1 PROTEIN; HISTONE; IRON; OXYGEN; UNCLASSIFIED DRUG;

ARTICLE; CHEMICAL BINDING; CHEMICAL REACTION KINETICS; CONTROLLED STUDY; DECARBOXYLATION; DENSITY FUNCTIONAL THEORY; ELECTRON; MOLECULAR STABILITY; RAMAN SPECTROMETRY; SPECTROSCOPY; ULTRAVIOLET SPECTROSCOPY;

ACINETOBACTER; BINDING SITES; DIOXYGENASES; KETO ACIDS; KETONES; MODELS, MOLECULAR; OXYGEN; PROTEIN BINDING; SPECTRUM ANALYSIS;

EID: 80053507967     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja203005j     Document Type: Article

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