Spectroscopic and computational studies of the azide-adduct of manganese superoxide dismutase: Definitive assignment of the ligand responsible for the low-temperature thermochromism

Journal of the American Chemical Society

Volumn 126, Issue 39, 2004, Pages 12477-12491

  Jackson, Timothy A ^a   Karapetian, Anush ^b   Miller, Anne Frances ^b   Brunold, Thomas C ^a  

^a UNIVERSITY OF WISCONSIN MADISON   (United States)

^b UNIVERSITY OF KENTUCKY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

BIOCHEMISTRY; CHARGE TRANSFER; COMPUTATIONAL METHODS; DATA ACQUISITION; ESCHERICHIA COLI; HYDROGEN BONDS; MOLECULAR STRUCTURE; PROBABILITY DENSITY FUNCTION; RAMAN SCATTERING;

LIGAND TO METAL CHARGE TRANSFER (LMCT); LIGANDS; MAGNETIC CIRCULAR DICHROISM (MCD); TRANSITION ENERGIES;

ENZYMES;

ASPARTIC ACID; AZIDE; BACTERIAL ENZYME; COORDINATION COMPOUND; FLUORINE; LIGAND; MANGANESE; MANGANESE SUPEROXIDE DISMUTASE; NITROGEN; TYROSINE; YTTRIUM;

ARTICLE; CIRCULAR DICHROISM; COLOR; COORDINATION NUMBER; DENSITY FUNCTIONAL THEORY; DISSOCIATION; ELECTRICITY; ENZYME ACTIVE SITE; ENZYME SUBSTRATE; ENZYME SUBSTRATE COMPLEX; ESCHERICHIA COLI; HEAT; HYDROGEN BOND; LIGAND TO METAL CHARGE TRANSFER; LOW TEMPERATURE; MAGNETIC CIRCUAL DICHROISM SPECTROSCOPY; MAGNETISM; MATHEMATICAL COMPUTING; METAL BINDING; MOLECULAR INTERACTION; OXIDATION; PREDICTION AND FORECASTING; QUANTUM CHEMISTRY; RAMAN SPECTROMETRY; SPECTROSCOPY; THERMOCHROMISM;

AZIDES; BINDING SITES; COLD; ESCHERICHIA COLI; MODELS, MOLECULAR; MUTAGENESIS, SITE-DIRECTED; SPECTRUM ANALYSIS, RAMAN; SUPEROXIDE DISMUTASE; THERMODYNAMICS;

EID: 4644220652     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja0482583     Document Type: Article

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