Identification of Conserved Water Sites in Protein Structures for Drug Design-Reference-Cited by-同舟云学术

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Identification of Conserved Water Sites in Protein Structures for Drug Design

Published:2017-12-04 Issue:12 Volume:57 Page:3094-3103
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Jukič Marko¹,Konc Janez²³,Gobec Stanislav¹^ORCID,Janežič Dušanka³^ORCID

Affiliation:

1. Faculty of Pharmacy, University of Ljubljana, Aškerčeva 7, SI−1000, Ljubljana, Slovenia

2. National Institute of Chemistry, Hajdrihova 19, SI−1000, Ljubljana, Slovenia

3. Faculty of Mathematics, Natural Sciences and Information Technologies, University of Primorska, Glagoljaška 8, SI−6000 Koper, Slovenia

Funder

Javna Agencija za Raziskovalno Dejavnost RS

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.7b00443

Reference71 articles.

1. Hydrogen Bonding: The Last Mystery in Drug Design?

2. Hydration in drug design. 3. Conserved water molecules at the ligand-binding sites of homologous proteins

3. Conserved Water Molecules Stabilize the Ω-Loop in Class A β-Lactamases

4. Exploration of Interfacial Hydration Networks of Target–Ligand Complexes

5. 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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1. Enthalpic Classification of Water Molecules in Target–Ligand Binding;Journal of Chemical Information and Modeling;2024-08-13

2. Water position sampling on protein structures based on a 3D distribution function using a weighted Monte Carlo method;Bulletin of the Chemical Society of Japan;2024-06

3. The impact of water and ionic liquid on the structure and stability of biomolecules;Encyclopedia of Solid-Liquid Interfaces;2024

4. Water and chloride as allosteric inhibitors in WNK kinase osmosensing;2023-08-31

5. Identifying Metal Binding Sites in Proteins Using Homologous Structures, the MADE Approach;Journal of Chemical Information and Modeling;2023-08-09

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