Laboratorio de Biofísica Molecular
Time averaging of NMR chemical shifts in the MLF peptide in the solid state
De Gortari I, Portella G, Salvatella X, Bajaj VS, van der Wel PCA, Yates JR, Segall MD, Pickard CJ, Payne MC and Vendruscolo M.
J Am Chem Soc (In press) (2010)
Refinement of ensembles describing unstructured proteins
Esteban-Martín S, Fenwick RB and Salvatella X.
J Am Chem Soc (2010)
The non-core regions of human lysozyme amyloid fibrils give rise to cytotoxicity
Mossuto MF, Dhulesia A, Devlin G, Frare E, Kumita JR, Polverino de Laureto P, Dumoulin M, Fontana A, Dobson CM and Salvatella X.
J Mol Biol (in press) (2010)
Towards an accurate description of free energies in solution states of proteins
De Simone A, Richter B, Salvatella X and Vendruscolo M
J Am Chem Soc, 131, 3810-3811 (2009)
Position-dependent electrostatic protection against protein aggregation
Buell A, Tartaglia GG, Birkett NR, Waudby CA, Vendruscolo M, Salvatella X, Welland ME, Dobson CM and Knowles T
ChemBioChem, 10 (8), 1309-1312 (2009)
Folding of small proteins by monte carlo simulations with chemical shift restraints without the use of molecular fragment replacement or structural homology
Robustelli P, Cavalli A, Dobson CM, Vendruscolo M and Salvatella X
J Phys Chem B (published online May 8, 2009) (2009)
Solution structure and dynamics of the small GTPase RalB in its active conformation: significance for effector protein binding
Fenwick R, Prasannan S, Campbell L, Nietlispach D, Evetts K, Camonis J, Mott H and Owen D
Biochemistry (in press) (2009)
Characterization of oligomeric species on the aggregation pathway of human lysozyme
Frare E, Mossuto MF, de Laureto PP, Tolin S, Menzer L, Dumoulin M, Dobson CM, and Fontana A
J Mol Biol, 387 (1), 17-27 (2009)
Fast and accurate predictions of protein NMR chemical shifts from interatomic distances
Kohlhoff KJ, Robustelli P, Cavalli A, Salvatella X and Vendruscolo M
J Am Chem Soc, 131 (39), 13894-13895 (2009)
Influence of the fluctuations of the alignment tensor on the analysis of the structure and dynamics of proteins using residual dipolar couplings
Salvatella X, Richter B and Vendruscolo M
J Biomol NMR, 40 (1), 71-81 (2008)
Structure and dynamics of a partially folded protein are decoupled from its mechanism of aggregation
Calloni G, Lendel S, Campioni S, Gianinni S, Gliozzi A, Relini A, Vendruscolo M, Dobson CM, Salvatella X and Chiti F
J Am Chem Soc, 130 (39), 13040-13050 (2008)
Structure determination of protein-protein complexes using NMR chemical shifts: Case of an endonuclease colicin-immunity protein complex
Montalvao RW, Cavalli A, Salvatella X, Blundell TL and Vendruscolo M
J Am Chem Soc, 130, 15990-15996 (2008)
Conformational properties of the aggregation precursor state of HypF-N
Campioni S, Mossuto MF, Torrassa S, Calloni G, de Laureto PP, Relini A, Fontana A and Chiti F
J Mol Biol, 379 (3), 554-567 (2008)
Characterisation of transition state structures for protein folding using 'high', 'medium' and 'low' {Phi}-values
Geierhaas CD, Salvatella X, Clarke J and Vendruscolo M
Protein Eng Des Sel, 21 (3), 215-222 (2008)
Structural analysis of substance P using molecular dynamics and NMR spectroscopy
Corcho FJ, Salvatella X, Canto J, Giralt E and Perez JJ
J Pept Sci, 13 (11), 728-741 (2007)
Protein structure determination from NMR chemical shifts
Cavalli A, Salvatella X, Dobson CM and Vendruscolo M
Proc Natl Acad Sci USA, 104 (23), 9615-9620 (2007)
The MUMO (minimal under-restraining minimal over-restraining) method for the determination of native state ensembles of proteins
Richter B, Gsponer J, Várnai P, Salvatella X and Vendruscolo M
J Biomol NMR, 37 (2), 117-135 (2007)
Determination of the folding transition states of barnase by using PhiI-value-restrained simulations validated by double mutant PhiIJ-values
Salvatella X, Dobson CM, Fersht AR and Vendruscolo M
Proc Natl Acad Sci USA, 102 (35), 12389-12394 (2005)
A new class of foldamers based on cis-gamma-amino-L-proline
Farrera-Sinfreu J, Zaccaro L, Vidal D, Salvatella X, Giralt E, Pons M, Albericio F and Royo M
J Am Chem Soc, 126 (19), 6048-6057 (2004)
Low-populated folding intermediates of Fyn SH3 characterized by relaxation dispersion NMR
Korzhnev DM, Salvatella X, Vendruscolo M, Di Nardo AA, Davidson AR, Dobson CM and Kay LE
Nature, 430 (6999), 586-590 (2004)
A tetraguanidinium ligand binds to the surface of the tetramerization domain of protein P53
Salvatella X, Martinell M, Gairí M, Mateu MG, Feliz M, Hamilton AD, De Mendoza J and Giralt E
Angew Chem Int Ed Engl, 43 (2), 196-198 (2004)
NMR-based methods and strategies for drug discovery
Salvatella X and Giralt E
Chem Soc Rev, 32 (6), 365-372 (2003)
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