Mechanism of the conformational change of the F1-ATPase β subunit revealed by free energy simulations

Journal of the American Chemical Society

Volumn 133, Issue 10, 2011, Pages 3372-3380

  Ito, Yuko ^a   Oroguchi, Tomotaka ^a   Ikeguchi, Mitsunori ^a  

^a YOKOHAMA CITY UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

ATP BINDING; C-TERMINAL DOMAINS; CLOSED FORM; CONFORMATIONAL CHANGE; DRIVING FORCES; DYNAMIC MOVEMENTS; EXPERIMENTAL DATA; EXPLICIT SOLVENTS; FREE ENERGY SIMULATIONS; HYDROGEN BOND NETWORKS; HYDROPHOBIC CORE; ROTARY MOTOR; WATER MOLECULE;

BINDING ENERGY; FREE ENERGY; HYDROPHOBICITY;

CONFORMATIONS;

ADENOSINE TRIPHOSPHATE; PROTON TRANSPORTING ADENOSINE TRIPHOSPHATE SYNTHASE; SOLVENT; WATER;

ARTICLE; ATOM; BETA CHAIN; CARBOXY TERMINAL SEQUENCE; CONFORMATIONAL TRANSITION; ENERGY; HYDROGEN BOND; HYDROPHOBICITY; MOLECULE; PROTEIN BINDING; PROTEIN STRUCTURE; SIMULATION; TORQUE;

ADENOSINE TRIPHOSPHATE; CRYSTALLOGRAPHY, X-RAY; ENTROPY; PROTEIN CONFORMATION; PROTEIN SUBUNITS; PROTON-TRANSLOCATING ATPASES;

EID: 79952607783     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja1070152     Document Type: Article

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