Quantum chemical 13Cα chemical shift calculations for protein NMR structure determination, refinement, and validation

Proceedings of the National Academy of Sciences of the United States of America

Volumn 105, Issue 38, 2008, Pages 14389-14394

  Vila, Jorge A ^a,b   Aramini, James M ^c   Rossi, Paolo ^c   Kuzin, Alexandre ^d   Su, Min ^d   Seetharaman, Jayaraman ^d   Xiao, Rong ^c   Tong, Liang ^d   Montelione, Gaetano T ^c,e   Scheraga, Harold A ^a  

^a Department of Obstetrics Gynecology   (United States)

^b UNIVERSIDAD NACIONAL DE SAN LUIS   (Argentina)

^c RUTGERS UNIVERSITY   (United States)

^d Och Spine at New York Presbyterian Hospitals   (United States)

^e RUTGERS ROBERT WOOD JOHNSON MEDICAL SCHOOL   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AMINO ACID SEQUENCE; ARTICLE; CARBON NUCLEAR MAGNETIC RESONANCE; PRIORITY JOURNAL; PROTEIN ANALYSIS; PROTEIN CONFORMATION; PROTON NUCLEAR MAGNETIC RESONANCE; VALIDATION PROCESS; X RAY CRYSTALLOGRAPHY; BACILLUS SUBTILIS; CHEMICAL STRUCTURE; CHEMISTRY; HYDROGEN BOND; MECHANICAL TORSION; NUCLEAR MAGNETIC RESONANCE; PROTEIN TERTIARY STRUCTURE; REPRODUCIBILITY;

BACTERIAL PROTEIN; CARBON;

BACILLUS SUBTILIS; BACTERIAL PROTEINS; CARBON ISOTOPES; CRYSTALLOGRAPHY, X-RAY; HYDROGEN BONDING; MODELS, MOLECULAR; NUCLEAR MAGNETIC RESONANCE, BIOMOLECULAR; PROTEIN STRUCTURE, TERTIARY; REPRODUCIBILITY OF RESULTS; TORSION, MECHANICAL;

EID: 55749100006     PISSN: 00278424     EISSN: 10916490     Source Type: Journal    
DOI: 10.1073/pnas.0807105105     Document Type: Article

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