Spectroscopic and density functional studies of the red copper site in nitrosocyanin: Role of the protein in determining active site geometric and electronic structure

Journal of the American Chemical Society

Volumn 127, Issue 10, 2005, Pages 3531-3544

  Basumallick, Lipika ^a   Sarangi, Ritimukta ^a   DeBeer George, Serena ^b   Elmore, Brad ^c   Hooper, Alan B ^c   Hedman, Britt ^b   Hodgson, Keith O ^a,b   Solomon, Edward I ^a  

^a STANFORD UNIVERSITY   (United States)

^b SLAC NATIONAL ACCELERATOR LABORATORY   (United States)

^c UNIVERSITY OF MINNESOTA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL BONDS; DATA REDUCTION; ELECTRONIC STRUCTURE; PARAMAGNETIC RESONANCE; PROBABILITY DENSITY FUNCTION; PROTEINS; REDOX REACTIONS; SULFUR; X RAY ANALYSIS;

ACTIVE SITES; CIRCULAR DICHROISM; NITROSOCYANIN; PLASTOCYANIN;

COPPER;

COPPER; CYSTEINE; NITROSO DERIVATIVE; NITROSOCYANIN; PLASTOCYANIN; SULFUR; UNCLASSIFIED DRUG;

ABSORPTION; ARTICLE; CHEMICAL BOND; CIRCULAR DICHROISM; COVALENT BOND; CRYSTAL STRUCTURE; DENSITY FUNCTIONAL THEORY; ELECTRON SPIN RESONANCE; ELECTRON TRANSPORT; LIGAND BINDING; LOW TEMPERATURE; MAGNETISM; MATHEMATICAL ANALYSIS; OXIDATION REDUCTION REACTION; PROTEIN STRUCTURE; RAMAN SPECTROMETRY; X RAY SPECTROMETRY;

BACTERIAL PROTEINS; BINDING SITES; CIRCULAR DICHROISM; COPPER; CRYSTALLOGRAPHY, X-RAY; ELECTRON SPIN RESONANCE SPECTROSCOPY; METALLOPROTEINS; MODELS, MOLECULAR; MOLECULAR STRUCTURE; NITROSOMONAS EUROPAEA; OXIDATION-REDUCTION; SPECTRUM ANALYSIS, RAMAN;

EID: 14944379569     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja044412+     Document Type: Article

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