Characterization of [4Fe-4S] cluster vibrations and structure in nitrogenase Fe protein at three oxidation levels via combined NRVS, EXAFS, and DFT analyses

Journal of the American Chemical Society

Volumn 135, Issue 7, 2013, Pages 2530-2543

  Mitra, Devrani ^a   George, Simon J ^b,c   Guo, Yisong ^b   Kamali, Saeed ^b   Keable, Stephen ^d   Peters, John W ^d   Pelmenschikov, Vladimir ^e   Case, David A ^f   Cramer, Stephen P ^b,c  

^a UNIVERSITY OF CHICAGO   (United States)

^b UNIVERSITY OF CALIFORNIA   (United States)

^c LAWRENCE BERKELEY NATIONAL LABORATORY   (United States)

^d MONTANA STATE UNIVERSITY   (United States)

^e TECHNISCHE UNIVERSITÄT BERLIN   (Germany)

^f RUTGERS UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ANALYTICAL METHODOLOGY; BROKEN SYMMETRY; CLUSTER SYMMETRY; DFT CALCULATION; EXAFS; EXAFS ANALYSIS; EXAFS DATA; FE-PROTEINS; OXIDATION LEVEL; REDOX STATE; RESONANCE RAMAN SPECTRA; SECOND ELECTRONS; STRETCHING FREQUENCY; STRUCTURAL CHANGE; STRUCTURAL DISORDERS;

DENSITY FUNCTIONAL THEORY; EXTENDED X RAY ABSORPTION FINE STRUCTURE SPECTROSCOPY; OXIDATION; PROTEINS;

ELECTRON SPIN RESONANCE SPECTROSCOPY;

AMINO ACID; GLYCEROL; IRON; NITROGENASE; NITROGENASE IRON PROTEIN; SULFUR; UNCLASSIFIED DRUG;

ARTICLE; DENSITY FUNCTIONAL THEORY; ELECTRON; OXIDATION; OXIDATION REDUCTION REACTION; PROTEIN STRUCTURE; RAMAN SPECTROMETRY; VIBRATION; X RAY ABSORPTION SPECTROSCOPY;

FOURIER ANALYSIS; MODELS, MOLECULAR; OXIDATION-REDUCTION; OXIDOREDUCTASES; QUANTUM THEORY; VIBRATION;

EID: 84874059297     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja307027n     Document Type: Article

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