Evidence, from simulations, of a single state with residual native structure at the thermal denaturation midpoint of a small globular protein

Journal of the American Chemical Society

Volumn 132, Issue 27, 2010, Pages 9444-9452

  Maisuradze, Gia G ^a   Liwo, Adam ^a,b   Ołdziej, Stanisław ^a,b   Scheraga, Harold A ^a  

^a Department of Obstetrics Gynecology   (United States)

^b UNIVERSITY OF GDA SK   (Poland)

Author keywords

[No Author keywords available]

Indexed keywords

CANONICAL SIMULATIONS; COARSE-GRAINED; CONFORMATIONAL ENSEMBLE; FOLDED STATE; FORCE FIELDS; GLOBULAR PROTEINS; HELIX BUNDLE; HYDROPHOBIC CONTACT; INTERMEDIATE STATE; KINETIC TRAPS; LOW TEMPERATURES; MIRROR IMAGES; MULTI STATE; NATIVE CONFORMATION; NATIVE STATE; NON-POLAR; QUASI-CHEMICAL; REPLICA EXCHANGE SIMULATION; REPLICA-EXCHANGE MOLECULAR DYNAMICS SIMULATIONS; RESIDUAL NATIVE STRUCTURE; SECONDARY STRUCTURES; SINGLE STATE; STAPHYLOCOCCAL PROTEIN; THERMAL DENATURATIONS; THERMALLY STABLE; TRANSITION TEMPERATURE;

MOLECULAR DYNAMICS; MULTIPLEXING; PROTEIN FOLDING;

CONFORMATIONS;

GLOBULAR PROTEIN; HYDROGEN; STAPHYLOCOCCUS PROTEIN A;

ALPHA HELIX; ARTICLE; CARBOXY TERMINAL SEQUENCE; ENTHALPY; HYDROGEN BOND; HYDROPHOBICITY; MOLECULAR DYNAMICS; PHASE TRANSITION; PROTEIN CONFORMATION; PROTEIN DENATURATION; PROTEIN FOLDING; PROTEIN STRUCTURE; SIMULATION; STEADY STATE; THERMOSTABILITY; TRANSITION TEMPERATURE; CHEMISTRY; HEAT; TEMPERATURE;

HOT TEMPERATURE; MOLECULAR DYNAMICS SIMULATION; PHASE TRANSITION; PROTEIN CONFORMATION; PROTEIN DENATURATION; PROTEIN FOLDING; STAPHYLOCOCCAL PROTEIN A; TEMPERATURE;

EID: 77955792308     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja1031503     Document Type: Article

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