Diederich F - Search Results

1

The hit-and-return system enables efficient time-resolved serial synchrotron crystallography.

Schulz EC, Mehrabi P, Müller-Werkmeister HM, Tellkamp F, Jha A, Stuart W, Persch E, De Gasparo R, Diederich F, Pai EF, Miller RJD. Schulz EC, et al. Among authors: diederich f. Nat Methods. 2018 Nov;15(11):901-904. doi: 10.1038/s41592-018-0180-2. Epub 2018 Oct 30. Nat Methods. 2018. PMID: 30377366

2

Binding to large enzyme pockets: small-molecule inhibitors of trypanothione reductase.

Persch E, Bryson S, Todoroff NK, Eberle C, Thelemann J, Dirdjaja N, Kaiser M, Weber M, Derbani H, Brun R, Schneider G, Pai EF, Krauth-Siegel RL, Diederich F. Persch E, et al. Among authors: diederich f. ChemMedChem. 2014 Aug;9(8):1880-91. doi: 10.1002/cmdc.201402032. Epub 2014 Apr 30. ChemMedChem. 2014. PMID: 24788386

3

Biological Evaluation and X-ray Co-crystal Structures of Cyclohexylpyrrolidine Ligands for Trypanothione Reductase, an Enzyme from the Redox Metabolism of Trypanosoma.

De Gasparo R, Brodbeck-Persch E, Bryson S, Hentzen NB, Kaiser M, Pai EF, Krauth-Siegel RL, Diederich F. De Gasparo R, et al. Among authors: diederich f. ChemMedChem. 2018 May 8;13(9):957-967. doi: 10.1002/cmdc.201800067. Epub 2018 Apr 6. ChemMedChem. 2018. PMID: 29624890

4

Targeting a Large Active Site: Structure-Based Design of Nanomolar Inhibitors of Trypanosoma brucei Trypanothione Reductase.

De Gasparo R, Halgas O, Harangozo D, Kaiser M, Pai EF, Krauth-Siegel RL, Diederich F. De Gasparo R, et al. Among authors: diederich f. Chemistry. 2019 Sep 2;25(49):11416-11421. doi: 10.1002/chem.201901664. Epub 2019 Aug 13. Chemistry. 2019. PMID: 31407832

5

Molecular recognition in chemical and biological systems.

Persch E, Dumele O, Diederich F. Persch E, et al. Among authors: diederich f. Angew Chem Int Ed Engl. 2015 Mar 9;54(11):3290-327. doi: 10.1002/anie.201408487. Epub 2015 Jan 28. Angew Chem Int Ed Engl. 2015. PMID: 25630692 Review.

6

De novo design, synthesis, and in vitro evaluation of inhibitors for prokaryotic tRNA-guanine transglycosylase: a dramatic sulfur effect on binding affinity.

Meyer EA, Brenk R, Castellano RK, Furler M, Klebe G, Diederich F. Meyer EA, et al. Among authors: diederich f. Chembiochem. 2002 Mar 1;3(2-3):250-3. doi: 10.1002/1439-7633(20020301)3:2/3<250::AID-CBIC250>3.0.CO;2-J. Chembiochem. 2002. PMID: 11921407 No abstract available.

7

Fragment Screening Hit Draws Attention to a Novel Transient Pocket Adjacent to the Recognition Site of the tRNA-Modifying Enzyme TGT.

Hassaan E, Hohn C, Ehrmann FR, Goetzke FW, Movsisyan L, Hüfner-Wulsdorf T, Sebastiani M, Härtsch A, Reuter K, Diederich F, Klebe G. Hassaan E, et al. Among authors: diederich f. J Med Chem. 2020 Jul 9;63(13):6802-6820. doi: 10.1021/acs.jmedchem.0c00115. Epub 2020 Jun 25. J Med Chem. 2020. PMID: 32515955

8

Self-association based on orthogonal C=O...C=O interactions in the solid and liquid state.

Fäh C, Hardegger LA, Ebert MO, Schweizer WB, Diederich F. Fäh C, et al. Among authors: diederich f. Chem Commun (Camb). 2010 Jan 7;46(1):67-9. doi: 10.1039/b912721f. Epub 2009 Nov 6. Chem Commun (Camb). 2010. PMID: 20024295

9

Replacement of water molecules in a phosphate binding site by furanoside-appended lin-benzoguanine ligands of tRNA-guanine transglycosylase (TGT).

Barandun LJ, Ehrmann FR, Zimmerli D, Immekus F, Giroud M, Grünenfelder C, Schweizer WB, Bernet B, Betz M, Heine A, Klebe G, Diederich F. Barandun LJ, et al. Among authors: diederich f. Chemistry. 2015 Jan 2;21(1):126-35. doi: 10.1002/chem.201405764. Epub 2014 Dec 5. Chemistry. 2015. PMID: 25483606

10

Free enthalpies of replacing water molecules in protein binding pockets.

Riniker S, Barandun LJ, Diederich F, Krämer O, Steffen A, van Gunsteren WF. Riniker S, et al. Among authors: diederich f. J Comput Aided Mol Des. 2012 Dec;26(12):1293-309. doi: 10.1007/s10822-012-9620-8. Epub 2012 Dec 18. J Comput Aided Mol Des. 2012. PMID: 23247390

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