Chromophore-in-protein modeling of the structures and resonance Raman spectra for type 1 copper proteins

Journal of the American Chemical Society

Volumn 120, Issue 49, 1998, Pages 12791-12797

  Qiu, Di ^a   Dasgupta, Siddharth ^b   Kozlowski, Pawel M ^a   Goddard, William A ^b   Spiro, Thomas G ^a  

^a PRINCETON UNIVERSITY   (United States)

^b California Institute of Technology   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AZURIN; COORDINATION COMPOUND; COPPER; CYSTEINE; ISOTOPE; METALLOPROTEIN; PLASTOCYANIN;

ARTICLE; CHEMICAL BOND; CHROMATOPHORE; ENZYME ACTIVE SITE; MOLECULAR MODEL; PROTEIN STRUCTURE; RAMAN SPECTROMETRY; SITE DIRECTED MUTAGENESIS; VIBRATION;

EID: 0032539205     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja964472i     Document Type: Article

References (11)

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11. The Caltech BioGraf (version 3.31) is based on the commercial version of POLYGRAF (version 3.21) distributed by Molecular Simulations Inc. (San Diego, CA) but enhanced with second derivative, vibrational frequency, and FF optimization (ref 17) models developed at Caltech.