Literature DB >> 10723993

Automation of NMR measurements and data evaluation for systematically screening interactions of small molecules with target proteins.

A Ross1, G Schlotterbeck, W Klaus, H Senn.   

Abstract

In this technical note we describe the setup and application of automated sample preparation and usage of flow-through NMR equipment for the characterization of ligand binding on proteins. In addition, we focus on the perspectives of automated analysis of 2D HSQC spectra to identify changes in patterns indicative for ligand binding or changes of sample conditions. In this context we discuss a combination of statistical and non-statistical data analysis.

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Year:  2000        PMID: 10723993     DOI: 10.1023/a:1008394910612

Source DB:  PubMed          Journal:  J Biomol NMR        ISSN: 0925-2738            Impact factor:   2.835


  20 in total

1.  Solution structure of the SH3 domain of Src and identification of its ligand-binding site.

Authors:  H Yu; M K Rosen; T B Shin; C Seidel-Dugan; J S Brugge; S L Schreiber
Journal:  Science       Date:  1992-12-04       Impact factor: 47.728

2.  Fast-HMQC using Ernst angle pulses: An efficient tool for screening of ligand binding to target proteins.

Authors:  A Ross; M Salzmann; H Senn
Journal:  J Biomol NMR       Date:  1997-12       Impact factor: 2.835

3.  Protein hydration in aqueous solution.

Authors:  G Otting; E Liepinsh; K Wüthrich
Journal:  Science       Date:  1991-11-15       Impact factor: 47.728

Review 4.  Locating and characterizing binding sites on proteins.

Authors:  C Mattos; D Ringe
Journal:  Nat Biotechnol       Date:  1996-05       Impact factor: 54.908

5.  Screening mixtures for biological activity by NMR.

Authors:  B Meyer; T Weimar; T Peters
Journal:  Eur J Biochem       Date:  1997-06-15

6.  Mapping of the binding interfaces of the proteins of the bacterial phosphotransferase system, HPr and IIAglc.

Authors:  Y Chen; J Reizer; M H Saier; W J Fairbrother; P E Wright
Journal:  Biochemistry       Date:  1993-01-12       Impact factor: 3.162

7.  Organic solvents identify specific ligand binding sites on protein surfaces.

Authors:  E Liepinsh; G Otting
Journal:  Nat Biotechnol       Date:  1997-03       Impact factor: 54.908

8.  Linear prediction enhancement of 2D heteronuclear correlated spectra of proteins.

Authors:  J J Led; H Gesmar
Journal:  J Biomol NMR       Date:  1991-09       Impact factor: 2.835

9.  Solution studies of staphylococcal nuclease H124L. 2. 1H, 13C, and 15N chemical shift assignments for the unligated enzyme and analysis of chemical shift changes that accompany formation of the nuclease-thymidine 3',5'-bisphosphate-calcium ternary complex.

Authors:  J F Wang; A P Hinck; S N Loh; D M LeMaster; J L Markley
Journal:  Biochemistry       Date:  1992-01-28       Impact factor: 3.162

10.  1H and 15N resonance assignments and secondary structure of cellular retinoic acid-binding protein with and without bound ligand.

Authors:  J Rizo; Z P Liu; L M Gierasch
Journal:  J Biomol NMR       Date:  1994-11       Impact factor: 2.835

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  8 in total

1.  Automated evaluation of chemical shift perturbation spectra: New approaches to quantitative analysis of receptor-ligand interaction NMR spectra.

Authors:  Chen Peng; Stephen W Unger; Fabian V Filipp; Michael Sattler; Sándor Szalma
Journal:  J Biomol NMR       Date:  2004-08       Impact factor: 2.835

2.  A general algorithm for peak-tracking in multi-dimensional NMR experiments.

Authors:  P Ravel; G Kister; T E Malliavin; M A Delsuc
Journal:  J Biomol NMR       Date:  2007-02-10       Impact factor: 2.835

3.  Modulation of the structure, catalytic activity, and fidelity of African swine fever virus DNA polymerase X by a reversible disulfide switch.

Authors:  Markus W Voehler; Robert L Eoff; W Hayes McDonald; F Peter Guengerich; Michael P Stone
Journal:  J Biol Chem       Date:  2009-05-05       Impact factor: 5.157

Review 4.  Analysis of bacterial biofilms using NMR-based metabolomics.

Authors:  Bo Zhang; Robert Powers
Journal:  Future Med Chem       Date:  2012-06       Impact factor: 3.808

5.  NMR-based fragment screening and lead discovery accelerated by principal component analysis.

Authors:  Andrew T Namanja; Jia Xu; Haihong Wu; Qi Sun; Anup K Upadhyay; Chaohong Sun; Steven R Van Doren; Andrew M Petros
Journal:  J Biomol NMR       Date:  2019-09-20       Impact factor: 2.835

6.  Binding site identification and structure determination of protein-ligand complexes by NMR a semiautomated approach.

Authors:  Joshua J Ziarek; Francis C Peterson; Betsy L Lytle; Brian F Volkman
Journal:  Methods Enzymol       Date:  2011       Impact factor: 1.600

Review 7.  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

8.  Protein-RNA specificity by high-throughput principal component analysis of NMR spectra.

Authors:  Katherine M Collins; Alain Oregioni; Laura E Robertson; Geoff Kelly; Andres Ramos
Journal:  Nucleic Acids Res       Date:  2015-01-13       Impact factor: 16.971

  8 in total

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