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Analysis of Energy Stabilization inside the Hydrophobic Core of Rubredoxin
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SYSNO ASEP 0327972 Document Type J - Journal Article R&D Document Type Journal Article Subsidiary J Článek ve WOS Title Analysis of Energy Stabilization inside the Hydrophobic Core of Rubredoxin Author(s) Berka, Karel (UOCHB-X)
Hobza, Pavel (UOCHB-X) RID, ORCID
Vondrášek, Jiří (UOCHB-X) RID, ORCIDNumber of authors 3 Source Title ChemPhysChem. - : Wiley - ISSN 1439-4235
Roč. 10, č. 3 (2009), s. 543-548Number of pages 6 s. Language eng - English Country DE - Germany Keywords hydrophobic core ; protein stability ; SAPT method Subject RIV CF - Physical ; Theoretical Chemistry R&D Projects GA203/05/0009 GA ČR - Czech Science Foundation (CSF) GA203/06/1727 GA ČR - Czech Science Foundation (CSF) GD203/05/H001 GA ČR - Czech Science Foundation (CSF) IAA400550510 GA AV ČR - Academy of Sciences of the Czech Republic (AV ČR) LC512 GA MŠMT - Ministry of Education, Youth and Sports (MEYS) CEZ AV0Z40550506 - UOCHB-X (2005-2011) UT WOS 000264229900014 DOI 10.1002/cphc.200800401 Annotation The hydrophobic core of globular proteins is responsible for major stabilization of the protein tertiary structure. The prevailing amino-acid residues in the core are of aliphatic or aromatic character, and therefore, the core in a folded protein structure is mostly stabilized by noncovalent interactions of van der Waals origin between the amino-acid side chains. Herein, we present a theoretical analysis of the interaction energy between the amino acids of the hydrophobic core of the small globular protein rubredoxin (Rd) based on the symmetry-adapted perturbation theory (SAPT) method. Workplace Institute of Organic Chemistry and Biochemistry Contact asep@uochb.cas.cz ; Kateřina Šperková, Tel.: 232 002 584 ; Viktorie Chládková, Tel.: 232 002 434 Year of Publishing 2010
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