MCCE analysis of the pKas of introduced buried acids and bases in staphylococcal nuclease. (Q51532804)

6 April 2018

title

MCCE analysis of the pKas of introduced buried acids and bases in staphylococcal nuclease. (English)

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6 April 2018

author name string

M R Gunner

series ordinal

1

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6 April 2018

Xuyu Zhu

series ordinal

2

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6 April 2018

Max C Klein

series ordinal

3

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6 April 2018

language of work or name

English

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publication date

9 September 2011

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6 April 2018

published in

Proteins

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6 April 2018

volume

79

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6 April 2018

issue

12

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6 April 2018

page(s)

3306-3319

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6 April 2018

Are acidic and basic groups in buried proteins predicted to be ionized?

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

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Charges in the hydrophobic interior of proteins

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High Apparent Dielectric Constant Inside a Protein Reflects Structural Reorganization Coupled to the Ionization of an Internal Asp

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A buried lysine that titrates with a normal pKa: Role of conformational flexibility at the protein-water interface as a determinant of pKavalues

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21 January 2018

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21 January 2018

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High apparent dielectric constants in the interior of a protein reflect water penetration

21 January 2018

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https://api.crossref.org/works/10.1002%2FPROT.23124

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21 January 2018

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21 January 2018

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21 January 2018

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21 January 2018

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21 January 2018

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Molecular dynamics study of water penetration in staphylococcal nuclease.

21 January 2018

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pKa of residue 66 in Staphylococal nuclease. I. Insights from QM/MM simulations with conventional sampling.

21 January 2018

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https://api.crossref.org/works/10.1002%2FPROT.23124

Structural origins of high apparent dielectric constants experienced by ionizable groups in the hydrophobic core of a protein

21 January 2018

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Semianalytical treatment of solvation for molecular mechanics and dynamics

21 January 2018

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In a staphylococcal nuclease mutant the side-chain of a lysine replacing valine 66 is fully buried in the hydrophobic core

21 January 2018

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What about protein polarity?

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FPROT.23124

21 January 2018

Identifiers

DOI

10.1002/PROT.23124

1 reference

6 April 2018

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6 April 2018