Modeling of ligation-induced helix/loop displacements in myoglobin: Toward an understanding of hemoglobin allostery

Journal of the American Chemical Society

Volumn 128, Issue 16, 2006, Pages 5427-5435

  Guallar, Victor ^a   Jarzecki, Andrzej A ^c,d   Friesner, Richard A ^b   Spiro, Thomas G ^c  

^a WASHINGTON UNIVERSITY SCHOOL OF MEDICINE   (United States)

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

^c PRINCETON UNIVERSITY   (United States)

^d CITY UNIVERSITY OF NEW YORK   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ALGORITHMS; CRYSTAL STRUCTURE; CRYSTALLOGRAPHY; DISSOCIATION; HYDROGEN BONDS; MOLECULAR DYNAMICS;

ALLOSTERIC PATHWAY; DELIGATION FORCES; MAIN-CHAIN SEGMENTAL MOTIONS; SEQUENCE-DISPLACEMENT GRAPHS;

PROTEINS;

CARBON MONOXIDE; DEOXYMYOGLOBIN; HEME; HEMOGLOBIN; HISTIDINE; IRON; MYOGLOBIN; UNCLASSIFIED DRUG; WATER;

ALGORITHM; ALLOSTERISM; ARTICLE; CRYSTAL STRUCTURE; CRYSTALLOGRAPHY; DISSOCIATION; HYDROGEN BOND; MOLECULAR MECHANICS; MOLECULAR MODEL; PROTEIN STRUCTURE; QUANTUM MECHANICS; STEREOCHEMISTRY;

ALLOSTERIC REGULATION; CRYSTALLOGRAPHY; HEMOGLOBINS; MODELS, MOLECULAR; MYOGLOBIN; QUANTUM THEORY;

EID: 33646449980     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja057318h     Document Type: Article

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