Structural and thermodynamic consequences of burial of an artificial ion pair in the hydrophobic interior of a protein

Uncovering the Determinants of a Highly Perturbed Tyrosine pKa in the Active Site of Ketosteroid Isomerase

(2013) Jason P. Schwans et al.   BIOCHEMISTRY

Engineering a model protein cavity to catalyze the Kemp elimination

(2012) M. Merski et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Structural Reorganization Triggered by Charging of Lys Residues in the Hydrophobic Interior of a Protein

(2012) Michael S. Chimenti et al.   STRUCTURE

Structural–Functional Role of Chloride in Photosystem II

(2011) Ivan Rivalta et al.   BIOCHEMISTRY

Thermodynamic principles for the engineering of pH-driven conformational switches and acid insensitive proteins

(2011) Peregrine Bell-Upp et al.   BIOPHYSICAL CHEMISTRY

Large shifts in pKa values of lysine residues buried inside a protein

(2011) D. G. Isom et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Arginine residues at internal positions in a protein are always charged

(2011) M. J. Harms et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Structural Origins of High Apparent Dielectric Constants Experienced by Ionizable Groups in the Hydrophobic Core of a Protein

(2010) Michael S. Chimenti et al.   JOURNAL OF MOLECULAR BIOLOGY

Theoretical Studies of Salt-Bridge Formation by Amino Acid Side Chains in Low and Medium Polarity Environments

(2010) Peter I. Nagy et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Charges in the hydrophobic interior of proteins

(2010) D. G. Isom et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Mobile unnatural amino acid side chains in the core of staphylococcal nuclease

(2010) Richard Wynn et al.   PROTEIN SCIENCE

Do salt bridges stabilize proteins? A continuum electrostatic analysis

(2010) Zachary S. Hendsch et al.   PROTEIN SCIENCE

Essentials for ATP Synthesis by F1F0ATP Synthases

(2009) Christoph von Ballmoos et al.   Annual Review of Biochemistry

The pKa Values of Acidic and Basic Residues Buried at the Same Internal Location in a Protein Are Governed by Different Factors

(2009) Michael J. Harms et al.   JOURNAL OF MOLECULAR BIOLOGY

Complete measurement of the pKa values of the carboxyl and imidazole groups in Bacillus circulans xylanase

(2009) Manish D. Joshi et al.   PROTEIN SCIENCE

Molecular determinants of the pKavalues of Asp and Glu residues in staphylococcal nuclease

(2009) Carlos A. Castañeda et al.   PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS

Generation of Nucleophilic Character in the Cys25/His159 Ion Pair of Papain Involves Trp177 but Not Asp158†

(2008) Sheraz Gul et al.   BIOCHEMISTRY

Progress inAb InitioQM/MM Free-Energy Simulations of Electrostatic Energies in Proteins: Accelerated QM/MM Studies of pKa, Redox Reactions and Solvation Free Energies†

(2008) Shina C. L. Kamerlin et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Electrostatic basis for the unidirectionality of the primary proton transfer in cytochrome c oxidase

(2008) A. V. Pisliakov et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

High tolerance for ionizable residues in the hydrophobic interior of proteins

(2008) D. G. Isom et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA