Agustina Rodriguez-Granillo
Agustina Rodriguez-Granillo
Verified email at schrodinger.com
Title
Cited by
Cited by
Year
Copper-transfer mechanism from the human chaperone Atox1 to a metal-binding domain of Wilson disease protein
A Rodriguez-Granillo, A Crespo, DA Estrin, P Wittung-Stafshede
The Journal of Physical Chemistry B 114 (10), 3698-3706, 2010
502010
Lysine-60 in copper chaperone Atox1 plays an essential role in adduct formation with a target Wilson disease domain
F Hussain, A Rodriguez-Granillo, P Wittung-Stafshede
Journal of the American Chemical Society 131 (45), 16371-16373, 2009
422009
Advantages and disadvantages of biodegradable platforms in drug eluting stents
A Rodriguez-Granillo, B Rubilar, G Rodriguez-Granillo, AE Rodriguez
World journal of cardiology 3 (3), 84, 2011
402011
Design of an in vitro biocatalytic cascade for the manufacture of islatravir
MA Huffman, A Fryszkowska, O Alvizo, M Borra-Garske, KR Campos, ...
Science 366 (6470), 1255-1259, 2019
392019
Computational Design of Thermostabilizing d-Amino Acid Substitutions
A Rodriguez-Granillo, S Annavarapu, L Zhang, RL Koder, V Nanda
Journal of the American Chemical Society 133 (46), 18750-18759, 2011
362011
Stability and ATP binding of the nucleotide-binding domain of the Wilson disease protein: effect of the common H1069Q mutation
A Rodriguez-Granillo, E Sedlak, P Wittung-Stafshede
Journal of molecular biology 383 (5), 1097-1111, 2008
322008
Structure and dynamics of Cu (I) binding in copper chaperones Atox1 and CopZ: a computer simulation study
A Rodriguez-Granillo, P Wittung-Stafshede
The Journal of Physical Chemistry B 112 (15), 4583-4593, 2008
322008
Conformational dynamics of metal-binding domains in Wilson disease protein: molecular insights into selective copper transfer
A Rodriguez-Granillo, A Crespo, P Wittung-Stafshede
Biochemistry 48 (25), 5849-5863, 2009
262009
Energetic selection of topology in ferredoxins
JD Kim, A Rodriguez-Granillo, DA Case, V Nanda, PG Falkowski
PLOS Comput Biol 8 (4), e1002463, 2012
242012
Quantum-mechanics methodologies in drug discovery: applications of docking and scoring in lead optimization
A Crespo, A Rodriguez-Granillo, VT Lim
Current Topics in Medicinal Chemistry 17 (23), 2663-2680, 2017
222017
Interdomain interactions modulate collective dynamics of the metal-binding domains in the Wilson disease protein
A Rodriguez-Granillo, A Crespo, P Wittung-Stafshede
The Journal of Physical Chemistry B 114 (5), 1836-1848, 2010
222010
Differential roles of Met10, Thr11, and Lys60 in structural dynamics of human copper chaperone Atox1
A Rodriguez-Granillo, P Wittung-Stafshede
Biochemistry 48 (5), 960-972, 2009
222009
Structural principles for computational and de novo design of 4Fe–4S metalloproteins
V Nanda, S Senn, DH Pike, A Rodriguez-Granillo, WA Hansen, SD Khare, ...
Biochimica et Biophysica Acta (BBA)-Bioenergetics 1857 (5), 531-538, 2016
162016
Tuning of copper-loop flexibility in Bacillus subtilis CopZ copper chaperone: role of conserved residues
A Rodriguez-Granillo, P Wittung-Stafshede
The Journal of Physical Chemistry B 113 (7), 1919-1932, 2009
142009
“Site and mutation”-specific predictions enable minimal directed evolution libraries
JC Moore, A Rodriguez-Granillo, A Crespo, S Govindarajan, M Welch, ...
ACS synthetic biology 7 (7), 1730-1741, 2018
132018
STAT5 transcriptional activity is impaired by LIF in a mammary epithelial cell line
AR Granillo, JC Boffi, L Baranao, E Kordon, A Pecci, A Guberman
Biochemical and biophysical research communications 356 (3), 727-732, 2007
102007
Effect of doxycycline on atherosclerosis: from bench to bedside
G A Rodriguez-Granillo, A Rodriguez-Granillo, J Milei
Recent patents on cardiovascular drug discovery 6 (1), 42-54, 2011
82011
Combination of HDX-MS and in silico modeling to study enzymatic reactivity and stereo-selectivity at different solvent conditions
AA Makarov, RE Iacob, GF Pirrone, A Rodriguez-Granillo, L Joyce, ...
Journal of Pharmaceutical and Biomedical Analysis 182, 113141, 2020
12020
KETOREDUCTASE POLYPEPTIDES AND POLYNUCLEOTIDES
JC Moore, J Liang, J Penfield, J Nazor, N Dellas, V Mitchell, D Duan, ...
US Patent App. 16/605,576, 2020
2020
Engineered pantothenate kinase variant enzymes
MT Borra-Garske, O Alvizo, LJ Miller, JB Slaton, AL Petkova, ...
US Patent App. 16/460,147, 2020
2020
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