| Integrated NMR and cryo-EM atomic-resolution structure determination of a half-megadalton enzyme complex DF Gauto, LF Estrozi, CD Schwieters, G Effantin, P Macek, R Sounier, ... Nature communications 10 (1), 2697, 2019 | 105 | 2019 |
| WATCLUST: a tool for improving the design of drugs based on protein-water interactions ED Lopez, JP Arcon, DF Gauto, AA Petruk, CP Modenutti, VG Dumas, ... Bioinformatics 31 (22), 3697-3699, 2015 | 57 | 2015 |
| Mechanistic Insights into Microsecond Time-Scale Motion of Solid Proteins Using Complementary 15N and 1H Relaxation Dispersion Techniques P Rovó, CA Smith, D Gauto, BL de Groot, P Schanda, R Linser Journal of the American Chemical Society 141 (2), 858-869, 2019 | 51 | 2019 |
| Protein topology determines cysteine oxidation fate: the case of sulfenyl amide formation among protein families LA Defelipe, E Lanzarotti, D Gauto, MA Marti, AG Turjanski PLoS computational biology 11 (3), e1004051, 2015 | 48 | 2015 |
| Carbohydrate-binding proteins: Dissecting ligand structures through solvent environment occupancy DF Gauto, S Di Lella, CMA Guardia, DA Estrin, MA Martí The Journal of Physical Chemistry B 113 (25), 8717-8724, 2009 | 48 | 2009 |
| Solvent structure improves docking prediction in lectin–carbohydrate complexes DF Gauto, AA Petruk, CP Modenutti, JI Blanco, S Di Lella, MA Martí Glycobiology 23 (2), 241-258, 2013 | 46 | 2013 |
| Aromatic Ring Dynamics, Thermal Activation, and Transient Conformations of a 468 kDa Enzyme by Specific 1H–13C Labeling and Fast Magic-Angle Spinning NMR DF Gauto, P Macek, A Barducci, H Fraga, A Hessel, T Terauchi, D Gajan, ... Journal of the American Chemical Society 141 (28), 11183-11195, 2019 | 44 | 2019 |
| Microsecond motions probed by near-rotary-resonance R1ρ 15N MAS NMR experiments: the model case of protein overall-rocking in crystals A Krushelnitsky, D Gauto, DC Rodriguez Camargo, P Schanda, ... Journal of Biomolecular NMR 71, 53-67, 2018 | 40 | 2018 |
| Solid‐state NMR H–N–(C)–H and H–N–C–C 3D/4D correlation experiments for resonance assignment of large proteins H Fraga, CA Arnaud, DF Gauto, M Audin, V Kurauskas, P Macek, ... ChemPhysChem 18 (19), 2697-2703, 2017 | 40 | 2017 |
| Sensitive proton-detected solid-state NMR spectroscopy of large proteins with selective CH 3 labelling: application to the 50S ribosome subunit V Kurauskas, E Crublet, P Macek, R Kerfah, DF Gauto, J Boisbouvier, ... Chemical communications 52 (61), 9558-9561, 2016 | 34 | 2016 |
| Structural basis for ligand recognition in a mushroom lectin: Solvent structure as specificity predictor DF Gauto, S Di Lella, DA Estrin, HL Monaco, MA Martí Carbohydrate research 346 (7), 939-948, 2011 | 34 | 2011 |
| Protein conformational dynamics studied by 15N and 1H R1ρ relaxation dispersion: application to wild-type and G53A ubiquitin crystals DF Gauto, A Hessel, P Rovó, V Kurauskas, R Linser, P Schanda Solid state nuclear magnetic resonance 87, 86-95, 2017 | 33 | 2017 |
| Targeted DNP for biomolecular solid-state NMR D Gauto, O Dakhlaoui, I Marin-Montesinos, S Hediger, G De Paëpe Chemical Science 12 (18), 6223-6237, 2021 | 32 | 2021 |
| An integrated computational analysis of the structure, dynamics, and ligand binding interactions of the human galectin network CMA Guardia, DF Gauto, S Di Lella, GA Rabinovich, MA Martí, DA Estrin Journal of chemical information and modeling 51 (8), 1918-1930, 2011 | 30 | 2011 |
| Ligand uptake modulation by internal water molecules and hydrophobic cavities in hemoglobins JP Bustamante, S Abbruzzetti, A Marcelli, D Gauto, L Boechi, A Bonamore, ... The Journal of Physical Chemistry B 118 (5), 1234-1245, 2014 | 28 | 2014 |
| Microsecond Protein Dynamics from Combined Bloch‐McConnell and Near‐Rotary‐Resonance R1p Relaxation‐Dispersion MAS NMR D Marion, DF Gauto, I Ayala, K Giandoreggio‐Barranco, P Schanda ChemPhysChem 20 (2), 276-284, 2019 | 27 | 2019 |
| Using crystallographic water properties for the analysis and prediction of lectin–carbohydrate complex structures C Modenutti, D Gauto, L Radusky, J Blanco, A Turjanski, S Hajos, ... Glycobiology 25 (2), 181-196, 2015 | 22 | 2015 |
| Functional control of a 0.5 MDa TET aminopeptidase by a flexible loop revealed by MAS NMR DF Gauto, P Macek, D Malinverni, H Fraga, M Paloni, I Sučec, A Hessel, ... Nature communications 13 (1), 1927, 2022 | 21 | 2022 |
| The key role of electrostatic interactions in the induced folding in RNA recognition by DCL1-A L Zhao, IP Suarez, DF Gauto, RM Rasia, J Wang Physical Chemistry Chemical Physics 20 (14), 9376-9388, 2018 | 10 | 2018 |
| dsRNA-protein interactions studied by molecular dynamics techniques. Unravelling dsRNA recognition by DCL1 SI Drusin, IP Suarez, DF Gauto, RM Rasia, DM Moreno Archives of Biochemistry and Biophysics 596, 118-125, 2016 | 10 | 2016 |
Paul SchandaInstitute of Science and Technology AustriaEmail verificata su ist.ac.at
