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Works (15)

Molecular basis for recognition of the Group A Carbohydrate backbone by the PlyC streptococcal bacteriophage endolysin

2021-03-20 | Other
DOI: 10.1101/2021.03.19.436156
Contributors: Harley King; Sowmya Ajay Castro; Juan A. Bueren-Calabuig; Amol Arunrao Pohane; Cynthia M. Scholte; Vincent A. Fischetti; Natalia Korotkova; Fabio Zuccotto; Daniel C. Nelson; Helge C. Dorfmueller
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Instability of aquaglyceroporin (AQP) 2 contributes to drug resistance in Trypanosoma brucei

PLOS Neglected Tropical Diseases
2020-07-09 | Journal article
DOI: 10.1371/journal.pntd.0008458
Contributors: Juan F. Quintana; Timothy G. Geary; Juan Bueren-Calabuig; Fabio Zuccotto; Harry P. de Koning; David Horn; Mark C. Field
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Instability of aquaglyceroporin (AQP) 2 contributes to drug resistance inTrypanosoma brucei

2020-02-23 | Preprint
DOI: 10.1101/2020.02.22.960963
Contributors: Juan F. Quintana; Juan Bueren-Calabuig; Fabio Zuccotto; Harry P. de Koning; David Horn; Mark C. Field
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Mechanism of allosteric activation of human mRNA cap methyltransferase (RNMT) by RAM: insights from accelerated molecular dynamics simulations

Nucleic Acids Research
2019-07-22 | Journal article
DOI: 10.1093/nar/gkz613
Contributors: Juan A Bueren-Calabuig; Marcus G. Bage; Victoria H Cowling; Andrei V Pisliakov
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Mechanism of allosteric activation of human mRNA cap methyltransferase (RNMT) by RAM: Insights from accelerated molecular dynamics simulations

2019-03-03 | Other
DOI: 10.1101/558502
Contributors: Juan A. Bueren-Calabuig; Marcus Bage; Victoria H. Cowling; Andrei V. Pisliakov
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Impact of Ser17 phosphorylation on the conformational dynamics of the oncoprotein MDM2

Biochemistry
2016 | Journal article
Source: Self-asserted source
Juan A. Bueren-Calabuig

Elucidation of ligand-dependent modulation of disorder-order transitions in the oncoprotein MDM2

PLoS Comput Biol
2015 | Journal article
Source: Self-asserted source
Juan A. Bueren-Calabuig

"Bioinformática con Ñ v1. 0": a collaborative project of young Spanish scientists to write a complete book about Bioinformatics

Book of …
2014 | Book chapter
Source: Self-asserted source
Juan A. Bueren-Calabuig

Unraveling the Differences of the Hydrolytic Activity of Trypanosoma cruzi trans-Sialidase and Trypanosoma rangeli Sialidase: A Quantum Mechanics--Molecular Mechanics Modeling Study

The Journal of Physical Chemistry B
2014 | Journal article
Source: Self-asserted source
Juan A. Bueren-Calabuig

Rationale for the opposite stereochemistry of the major monoadducts and interstrand crosslinks formed by mitomycin C and its decarbamoylated analogue at CpG steps in DNA and the effect of cytosine modification on reactivity

Organic & biomolecular chemistry
2012 | Journal article
Source: Self-asserted source
Juan A. Bueren-Calabuig

Mechanistic Insight into the Catalytic Activity of ββα-Metallonucleases from Computer Simulations: Vibrio vulnificus Periplasmic Nuclease as a Test Case

ChemBioChem
2011 | Journal article
Source: Self-asserted source
Juan A. Bueren-Calabuig

Temperature-induced melting of double-stranded DNA in the absence and presence of covalently bonded antitumour drugs: insight from molecular dynamics simulations

Nucleic acids research
2011 | Journal article
Source: Self-asserted source
Juan A. Bueren-Calabuig

XPF-dependent DNA breaks and RNA polymerase II arrest induced by antitumor DNA interstrand crosslinking-mimetic alkaloids

Chemistry & biology
2011 | Journal article
Source: Self-asserted source
Juan A. Bueren-Calabuig

PM01183, a new DNA minor groove covalent binder with potent in vitro and in vivo anti-tumour activity

British journal of pharmacology
2010 | Journal article
Source: Self-asserted source
Juan A. Bueren-Calabuig

Molecular pharmacology and antitumor activity of Zalypsis® in several human cancer cell lines

Biochemical pharmacology
2009 | Journal article
Source: Self-asserted source
Juan A. Bueren-Calabuig

Peer review (1 review for 1 publication/grant)

Review activity for Journal of computer-aided molecular design. (1)
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