A Comprehensive Study of Factors Affecting the Prediction of the pKa Shift of Asp26 in Thioredoxin Protein-Reference-Cited by-同舟云学术

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A Comprehensive Study of Factors Affecting the Prediction of the pK_a Shift of Asp₂₆ in Thioredoxin Protein

Published:2024-07-18 Issue:30 Volume:128 Page:7304-7312
ISSN:1520-6106
Container-title:The Journal of Physical Chemistry B
language:en
Short-container-title:J. Phys. Chem. B

Author:

Verma Shivani¹,Nair Nisanth N.¹^ORCID

Affiliation:

1. Department of Chemistry, Indian Institute of Technology Kanpur, Kanpur - 208016, India

Funder

Indian Institute of Technology Kanpur

Science and Engineering Research Board

Department of Science and Technology, Ministry of Science and Technology, India

Publisher

American Chemical Society (ACS)

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpcb.4c01516

Reference67 articles.

1. Proton Binding to Proteins: pKa Calculations with Explicit and Implicit Solvent Models

2. Electrostatic Effects in Proteins

3. Protein Ionizable Groups: pK Values and Their Contribution to Protein Stability and Solubility

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

5. High Apparent Dielectric Constants in the Interior of a Protein Reflect Water Penetration

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