Electrostatic pK a computations in proteins: Role of internal cavities-Reference-Cited by-同舟云学术

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Electrostatic pK a computations in proteins: Role of internal cavities

Published:2011-07-08 Issue:12 Volume:79 Page:3320-3332
ISSN:0887-3585
Container-title:Proteins: Structure, Function, and Bioinformatics
language:en
Short-container-title:Proteins

Author:

Meyer Tim,Kieseritzky Gernot,Knapp Ernst-Walter

Funder

Deutsche Forschungsgemeinschaft

Volkswagen Foundation

German National Academic Foundation

Publisher

Wiley

Subject

Molecular Biology,Biochemistry,Structural Biology

Link

http://onlinelibrary.wiley.com/wol1/doi/10.1002/prot.23092/fullpdf

Reference68 articles.

1. The deacylation step of acetylcholinesterase: computer simulation studies;Vagedes;J Am Chem Soc,2000

2. Computer simulation studies of the catalytic mechanism of human aldose reductase;Varnai;J Am Chem Soc,2000

3. Interpreting trends in the binding of cyclic ureas to HIV-1 protease;Mardis;J Mol Biol,2001

4. Calculating proton uptake/release and binding free energy taking into account ionization and conformation changes induced by protein-inhibitor association application to plasmepsin, cathepsin D and endothiapepsin-pepstatin complexes;Alexov;Proteins-Struct Funct Bioinformatics,2004

5. Electrostatic properties of protein-protein complexes;Kundrotas;Biophys J,2006

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2. Towards solvent regulated self-activation of N-terminal disulfide bond oxidoreductase-D;Physical Chemistry Chemical Physics;2022

3. Frontiers in Multiscale Modeling of Photoreceptor Proteins;Photochemistry and Photobiology;2021-02-13

4. pH-Dependent Conformational Changes Lead to a Highly Shifted pKa for a Buried Glutamic Acid Mutant of SNase;The Journal of Physical Chemistry B;2020-12-01

5. Charged residues at the pore extracellular half of the glycine receptor facilitate channel gating: a potential role played by electrostatic repulsion;The Journal of Physiology;2020-08-26

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