Literature DB >> 10825729

Applications of NMR in drug discovery.

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Abstract

In the half-century since its discovery, nuclear magnetic resonance (NMR) has become the single most powerful form of spectroscopy in both chemistry and structural biology. The dramatic technical advances over the past 10-15 years, which continue apace, have markedly increased the range of applications for NMR in the study of protein-ligand interactions. These form the basis for its most exciting uses in the drug discovery process, which range from the simple identification of whether a compound (or a component of a mixture) binds to a given protein, through to the determination of the full three-dimensional structure of the complex, with all the information this yields for structure-based drug design.

Year:  2000        PMID: 10825729     DOI: 10.1016/s1359-6446(00)01479-3

Source DB:  PubMed          Journal:  Drug Discov Today        ISSN: 1359-6446            Impact factor:   7.851


  13 in total

Review 1.  Applications of NMR to structure-based drug design in structural genomics.

Authors:  Robert Powers
Journal:  J Struct Funct Genomics       Date:  2002

2.  Fast 3D molecular superposition and similarity search in databases of flexible molecules.

Authors:  Andreas Krämer; Hans W Horn; Julia E Rice
Journal:  J Comput Aided Mol Des       Date:  2003-01       Impact factor: 3.686

3.  Advances in Nuclear Magnetic Resonance for Drug Discovery.

Authors:  Robert Powers
Journal:  Expert Opin Drug Discov       Date:  2009-10-01       Impact factor: 6.098

4.  Determining the optimal size of small molecule mixtures for high throughput NMR screening.

Authors:  Kelly A Mercier; Robert Powers
Journal:  J Biomol NMR       Date:  2005-03       Impact factor: 2.835

5.  The conformation of acetylcholine at its target site in the membrane-embedded nicotinic acetylcholine receptor.

Authors:  P T F Williamson; A Verhoeven; K W Miller; B H Meier; A Watts
Journal:  Proc Natl Acad Sci U S A       Date:  2007-11-07       Impact factor: 11.205

Review 6.  Application of NMR and molecular docking in structure-based drug discovery.

Authors:  Jaime L Stark; Robert Powers
Journal:  Top Curr Chem       Date:  2012

7.  Auto-FACE: an NMR based binding site mapping program for fast chemical exchange protein-ligand systems.

Authors:  Janarthanan Krishnamoorthy; Victor C K Yu; Yu-Keung Mok
Journal:  PLoS One       Date:  2010-02-18       Impact factor: 3.240

Review 8.  High-field solution NMR spectroscopy as a tool for assessing protein interactions with small molecule ligands.

Authors:  Andria L Skinner; Jennifer S Laurence
Journal:  J Pharm Sci       Date:  2008-11       Impact factor: 3.534

9.  Paramagnetic Ligand Tagging To Identify Protein Binding Sites.

Authors:  Ulrika Brath; Shashikala I Swamy; Alberte X Veiga; Ching-Chieh Tung; Filip Van Petegem; Máté Erdélyi
Journal:  J Am Chem Soc       Date:  2015-08-27       Impact factor: 15.419

10.  Real-time and label-free analysis of binding thermodynamics of carbohydrate-protein interactions on unfixed cancer cell surfaces using a QCM biosensor.

Authors:  Xueming Li; Siyu Song; Qi Shuai; Yihan Pei; Teodor Aastrup; Yuxin Pei; Zhichao Pei
Journal:  Sci Rep       Date:  2015-09-15       Impact factor: 4.379

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