Literature DB >> 18767090

Crystallography-independent determination of ligand binding modes.

Julien Orts1, Jennifer Tuma, Marcel Reese, S Kaspar Grimm, Peter Monecke, Stefan Bartoschek, Alexander Schiffer, K Ulrich Wendt, Christian Griesinger, Teresa Carlomagno.   

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Year:  2008        PMID： 18767090     DOI： 10.1002/anie.200801792

Source DB:  PubMed          Journal:  Angew Chem Int Ed Engl        ISSN： 1433-7851            Impact factor:   15.336


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  6 in total

1.  Data quality in drug discovery: the role of analytical performance in ligand binding assays.

Authors:  Hermann Wätzig; Imke Oltmann-Norden; Franziska Steinicke; Hassan A Alhazmi; Markus Nachbar; Deia Abd El-Hady; Hassan M Albishri; Knut Baumann; Thomas Exner; Frank M Böckler; Sami El Deeb
Journal:  J Comput Aided Mol Des       Date:  2015-06-13       Impact factor: 3.686

2.  Methyl probes in proteins for determining ligand binding mode in weak protein-ligand complexes.

Authors:  Biswaranjan Mohanty; Julien Orts; Geqing Wang; Stefan Nebl; Wesam S Alwan; Bradley C Doak; Martin L Williams; Begoña Heras; Mehdi Mobli; Martin J Scanlon
Journal:  Sci Rep       Date:  2022-07-04       Impact factor: 4.996

3.  The description of protein internal motions aids selection of ligand binding poses by the INPHARMA method.

Authors:  Benjamin Stauch; Julien Orts; Teresa Carlomagno
Journal:  J Biomol NMR       Date:  2012-09-22       Impact factor: 2.835

4.  Interpreting linear support vector machine models with heat map molecule coloring.

Authors:  Lars Rosenbaum; Georg Hinselmann; Andreas Jahn; Andreas Zell
Journal:  J Cheminform       Date:  2011-03-25       Impact factor: 5.514

5.  An NMR-based scoring function improves the accuracy of binding pose predictions by docking by two orders of magnitude.

Authors:  Julien Orts; Stefan Bartoschek; Christian Griesinger; Peter Monecke; Teresa Carlomagno
Journal:  J Biomol NMR       Date:  2011-12-14       Impact factor: 2.835

Review 6.  Spin ballet for sweet encounters: saturation-transfer difference NMR and X-ray crystallography complement each other in the elucidation of protein-glycan interactions.

Authors:  Bärbel S Blaum; Ursula Neu; Thomas Peters; Thilo Stehle
Journal:  Acta Crystallogr F Struct Biol Commun       Date:  2018-07-26       Impact factor: 1.056
  6 in total

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