Guallar V - Search Results

1

Conformational response to ligand binding in phosphomannomutase2: insights into inborn glycosylation disorder.

Andreotti G, Cabeza de Vaca I, Poziello A, Monti MC, Guallar V, Cubellis MV. Andreotti G, et al. Among authors: guallar v. J Biol Chem. 2014 Dec 12;289(50):34900-10. doi: 10.1074/jbc.M114.586362. Epub 2014 Oct 16. J Biol Chem. 2014. PMID: 25324542 Free PMC article.

2

Recent PELE Developments and Applications in Drug Discovery Campaigns.

Puch-Giner I, Molina A, Municoy M, Pérez C, Guallar V. Puch-Giner I, et al. Among authors: guallar v. Int J Mol Sci. 2022 Dec 17;23(24):16090. doi: 10.3390/ijms232416090. Int J Mol Sci. 2022. PMID: 36555731 Free PMC article. Review.

3

Ligand migration in the truncated hemoglobin-II from Mycobacterium tuberculosis: the role of G8 tryptophan.

Guallar V, Lu C, Borrelli K, Egawa T, Yeh SR. Guallar V, et al. J Biol Chem. 2009 Jan 30;284(5):3106-3116. doi: 10.1074/jbc.M806183200. Epub 2008 Nov 18. J Biol Chem. 2009. PMID: 19019831 Free PMC article.

4

Exploring hierarchical refinement techniques for induced fit docking with protein and ligand flexibility.

Borrelli KW, Cossins B, Guallar V. Borrelli KW, et al. Among authors: guallar v. J Comput Chem. 2010 Apr 30;31(6):1224-35. doi: 10.1002/jcc.21409. J Comput Chem. 2010. PMID: 19885871

5

Tryptogalinin is a tick Kunitz serine protease inhibitor with a unique intrinsic disorder.

Valdés JJ, Schwarz A, Cabeza de Vaca I, Calvo E, Pedra JH, Guallar V, Kotsyfakis M. Valdés JJ, et al. Among authors: guallar v. PLoS One. 2013 May 3;8(5):e62562. doi: 10.1371/journal.pone.0062562. Print 2013. PLoS One. 2013. PMID: 23658744 Free PMC article.

6

Atomic level rendering of DNA-drug encounter.

Lucas MF, Cabeza de Vaca I, Takahashi R, Rubio-Martínez J, Guallar V. Lucas MF, et al. Among authors: guallar v. Biophys J. 2014 Jan 21;106(2):421-9. doi: 10.1016/j.bpj.2013.11.4494. Biophys J. 2014. PMID: 24461017 Free PMC article.

7

An alternative mechanism for the methylation of phosphoethanolamine catalyzed by Plasmodium falciparum phosphoethanolamine methyltransferase.

Saen-Oon S, Lee SG, Jez JM, Guallar V. Saen-Oon S, et al. Among authors: guallar v. J Biol Chem. 2014 Dec 5;289(49):33815-25. doi: 10.1074/jbc.M114.611319. Epub 2014 Oct 6. J Biol Chem. 2014. PMID: 25288796 Free PMC article.

8

Insights into Laccase Engineering from Molecular Simulations: Toward a Binding-Focused Strategy.

Monza E, Lucas MF, Camarero S, Alejaldre LC, Martínez AT, Guallar V. Monza E, et al. Among authors: guallar v. J Phys Chem Lett. 2015 Apr 16;6(8):1447-53. doi: 10.1021/acs.jpclett.5b00225. Epub 2015 Apr 2. J Phys Chem Lett. 2015. PMID: 26263150

9

Direct Measurement of the Nanomechanical Stability of a Redox Protein Active Site and Its Dependence upon Metal Binding.

Giannotti MI, Cabeza de Vaca I, Artés JM, Sanz F, Guallar V, Gorostiza P. Giannotti MI, et al. Among authors: guallar v. J Phys Chem B. 2015 Sep 10;119(36):12050-8. doi: 10.1021/acs.jpcb.5b06382. Epub 2015 Aug 31. J Phys Chem B. 2015. PMID: 26305718

10

A theoretical multiscale treatment of protein-protein electron transfer: The ferredoxin/ferredoxin-NADP(+) reductase and flavodoxin/ferredoxin-NADP(+) reductase systems.

Saen-Oon S, Cabeza de Vaca I, Masone D, Medina M, Guallar V. Saen-Oon S, et al. Among authors: guallar v. Biochim Biophys Acta. 2015 Dec;1847(12):1530-8. doi: 10.1016/j.bbabio.2015.09.002. Epub 2015 Sep 16. Biochim Biophys Acta. 2015. PMID: 26385068 Free article.

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