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 | 437 | 2020 |
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 | 156 | 2021 |
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 | 140 | 2002 |
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 | 138 | 2018 |
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 | 127 | 2021 |
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 | 103 | 2017 |
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 | 103 | 2004 |
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 | 100 | 2017 |
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 | 47 | 2014 |
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 | 46 | 2018 |
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 | 44 | 2015 |
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 | 36 | 2017 |
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 | 35 | 2018 |
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 | 32 | 2021 |
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 | 29 | 2020 |
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 | 28 | 2020 |
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 | 26 | 2021 |
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 | 24 | 2000 |
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 | 23 | 2016 |
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 | 23 | 2015 |