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Crystallographic and electrophilic fragment screening of the SARS-CoV-2 main protease
A Douangamath, D Fearon, P Gehrtz, T Krojer, P Lukacik, CD Owen, ...
Nature communications 11 (1), 5047, 2020
4372020
Structure, mechanism and crystallographic fragment screening of the SARS-CoV-2 NSP13 helicase
JA Newman, A Douangamath, S Yadzani, Y Yosaatmadja, A Aimon, ...
Nature communications 12 (1), 4848, 2021
1562021
Purification, characterization, gene cloning and preliminary X-ray data of the exo-inulinase from Aspergillus awamori
M Arand, AM Golubev, JRB Neto, I Polikarpov, R Wattiez, OS Korneeva, ...
Biochemical Journal 362 (1), 131-135, 2002
1402002
An expanded allosteric network in PTP1B by multitemperature crystallography, fragment screening, and covalent tethering
DA Keedy, ZB Hill, JT Biel, E Kang, TJ Rettenmaier, J Brandao-Neto, ...
Elife 7, e36307, 2018
1382018
Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking
M Schuller, GJ Correy, S Gahbauer, D Fearon, T Wu, RE Díaz, ID Young, ...
Science advances 7 (16), eabf8711, 2021
1272021
Gentle, fast and effective crystal soaking by acoustic dispensing
PM Collins, JT Ng, R Talon, K Nekrosiute, T Krojer, A Douangamath, ...
Acta Crystallographica Section D: Structural Biology 73 (3), 246-255, 2017
1032017
Crystal structure of α-galactosidase from Trichoderma reesei and its complex with galactose: implications for catalytic mechanism
AM Golubev, RAP Nagem, JRB Neto, KN Neustroev, EV Eneyskaya, ...
Journal of molecular biology 339 (2), 413-422, 2004
1032004
The XChemExplorer graphical workflow tool for routine or large-scale protein–ligand structure determination
T Krojer, R Talon, N Pearce, P Collins, A Douangamath, J Brandao-Neto, ...
Acta Crystallographica Section D: Structural Biology 73 (3), 267-278, 2017
1002017
Crystal structure of a Schistosoma mansoni septin reveals the phenomenon of strand slippage in septins dependent on the nature of the bound nucleotide
AE Zeraik, HM Pereira, YV Santos, J Brandão-Neto, M Spoerner, ...
Journal of Biological Chemistry 289 (11), 7799-7811, 2014
472014
Achieving a good crystal system for crystallographic X-ray fragment screening
PM Collins, A Douangamath, R Talon, A Dias, J Brandão-Neto, T Krojer, ...
Methods in enzymology 610, 251-264, 2018
462018
Crystal structure of an antifungal osmotin-like protein from Calotropis procera and its effects on Fusarium solani spores, as revealed by atomic force microscopy: Insights into …
MV Ramos, RSB de Oliveira, HM Pereira, FBMB Moreno, MDP Lobo, ...
Phytochemistry 119, 5-18, 2015
442015
Production in Pichia pastoris, antifungal activity and crystal structure of a class I chitinase from cowpea (Vigna unguiculata): Insights into sugar binding mode and hydrolytic …
PGC Landim, TO Correia, FDA Silva, DR Nepomuceno, HPS Costa, ...
Biochimie 135, 89-103, 2017
362017
An allosteric binding site of the α7 nicotinic acetylcholine receptor revealed in a humanized acetylcholine-binding protein
F Delbart, M Brams, F Gruss, S Noppen, S Peigneur, S Boland, P Chaltin, ...
Journal of Biological Chemistry 293 (7), 2534-2545, 2018
352018
Achieving efficient fragment screening at XChem facility at diamond light source
A Douangamath, A Powell, D Fearon, PM Collins, R Talon, T Krojer, ...
JoVE (Journal of Visualized Experiments), e62414, 2021
322021
A complete compendium of crystal structures for the human SEPT3 subgroup reveals functional plasticity at a specific septin interface
DKSV Castro, SMO da Silva, HDM Pereira, JNA Macedo, DA Leonardo, ...
IUCrJ 7 (3), 462-479, 2020
292020
Molecular recognition at septin interfaces: the switches hold the key
HVD Rosa, DA Leonardo, G Brognara, J Brandão-Neto, HDM Pereira, ...
Journal of molecular biology 432 (21), 5784-5801, 2020
282020
Orientational ambiguity in septin coiled coils and its structural basis
DA Leonardo, IA Cavini, FA Sala, DC Mendonça, HVD Rosa, PS Kumagai, ...
Journal of molecular biology 433 (9), 166889, 2021
262021
Purification, crystallization and preliminary X-ray study of β-xylosidase from Trichoderma reesei
AM Golubev, JR Brandao Neto, EV Eneyskaya, AV Kulminskaya, ...
Acta Crystallographica Section D: Biological Crystallography 56 (8), 1058-1060, 2000
242000
Structural and functional characterization of the phosphoglucomutase from Xanthomonas citri subsp. citri
LS Goto, AV Alexandrino, CM Pereira, CS Martins, HDM Pereira, ...
Biochimica et Biophysica Acta (BBA)-Proteins and Proteomics 1864 (12), 1658-1666, 2016
232016
Application of in situ diffraction in high-throughput structure determination platforms
P Aller, J Sanchez-Weatherby, J Foadi, G Winter, CMC Lobley, D Axford, ...
Structural Proteomics: High-Throughput Methods, 233-253, 2015
232015
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