Dual function of the hydration layer around an antifreeze protein revealed by atomistic molecular dynamics simulations

Journal of the American Chemical Society

Volumn 130, Issue 39, 2008, Pages 13066-13073

  Nutt, David R ^a,c   Smith, Jeremy C ^a,b  

^a UNIVERSITY OF HEIDELBERG   (Germany)

^b OAK RIDGE NATIONAL LABORATORY   (United States)

^c UNIVERSITY OF READING   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

ANTIFREEZE PROTEIN; AQUEOUS SOLUTIONS; ATOMISTIC MOLECULAR DYNAMICS SIMULATIONS; BINDING FACES; CHORISTONEURA FUMIFERANA; DUAL FUNCTION; DUAL ROLE; DYNAMIC PROPERTY; HYDRATION LAYERS; ICE GROWTH; ICE SURFACES; LOW TEMPERATURES; SOLVATION SHELL; SPRUCE BUDWORM; TRIANGULAR PRISM; WATER STRUCTURE;

BINDING ENERGY; BINDING SITES; DYNAMICS; FACE RECOGNITION; MOLECULAR DYNAMICS; PROTEINS; SOLVATION;

ICE;

ANTIFREEZE PROTEIN; ICE; WATER;

ARTICLE; CRYSTAL STRUCTURE; HYDRATION; HYDROGEN BOND; MOLECULAR DYNAMICS; PROTEIN BINDING; PROTEIN STRUCTURE; SOLVATION; WATER STRUCTURE; ANIMAL; CHEMICAL STRUCTURE; CHEMISTRY; MOTH; PROTEIN SECONDARY STRUCTURE;

ANIMALS; ANTIFREEZE PROTEINS; HYDROGEN BONDING; ICE; MODELS, MOLECULAR; MOTHS; PROTEIN STRUCTURE, SECONDARY; WATER;

EID: 58149148303     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja8034027     Document Type: Article

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