Metal ion roles and the movement of hydrogen during reaction catalyzed by D-xylose isomerase: A joint X-ray and neutron diffraction study AY Kovalevsky, L Hanson, SZ Fisher, M Mustyakimov, SA Mason, ... Structure 18 (6), 688-699, 2010 | 182 | 2010 |
Neutron crystallography: Opportunities, challenges, and limitations MP Blakeley, P Langan, N Niimura, A Podjarny Current Opinion in Structural Biology 18 (5), 593-600, 2008 | 177 | 2008 |
Neutron cryo-crystallography captures the protonation state of ferryl heme in a peroxidase CM Casadei, A Gumiero, CL Metcalfe, EJ Murphy, J Basran, MG Concilio, ... Science 345 (6193), 193-197, 2014 | 145 | 2014 |
Sub-atomic resolution X-ray crystallography and neutron crystallography: promise, challenges and potential MP Blakeley, SS Hasnain, SV Antonyuk IUCrJ 2 (4), 464-474, 2015 | 130 | 2015 |
A molecular mechanism for transthyretin amyloidogenesis AW Yee, M Aldeghi, MP Blakeley, A Ostermann, PJ Mas, M Moulin, ... Nature Communications 10, 925, 2019 | 120 | 2019 |
Neutron macromolecular crystallography MP Blakeley Crystallography Reviews 15 (3), 157-218, 2009 | 102 | 2009 |
Quantum model of catalysis based on a mobile proton revealed by subatomic X-ray and neutron diffraction studies of h-aldose reductase MP Blakeley, F Ruiz, R Cachau, I Hazemann, F Meilleur, A Mitschler, ... Proceedings of the National Academy of Sciences 105 (6), 1844-1848, 2008 | 97 | 2008 |
Neutron macromolecular crystallography with LADI-III MP Blakeley, SCM Teixeira, I Petit-Haertlein, I Hazemann, A Mitschler, ... Acta Crystallographica Section D: Biological Crystallography 66 (11), 1198-1205, 2010 | 95 | 2010 |
Neutron structure of type‐III antifreeze protein allows the reconstruction of AFP–ice interface EI Howard, MP Blakeley, M Haertlein, IP Haertlein, A Mitschler, SJ Fisher, ... Journal of Molecular Recognition 24 (4), 724-732, 2011 | 94 | 2011 |
The determination of protonation states in proteins HU Ahmed, MP Blakeley, M Cianci, DWJ Cruickshank, JA Hubbard, ... Acta Crystallographica Section D: Biological Crystallography 63 (8), 906-922, 2007 | 94 | 2007 |
High-resolution neutron protein crystallography with radically small crystal volumes: Application of perdeuteration to human aldose reductase I Hazemann, MT Dauvergne, MP Blakeley, F Meilleur, M Haertlein, ... Acta Crystallographica Section D: Biological Crystallography 61 (10), 1413-1417, 2005 | 93 | 2005 |
The 15-K neutron structure of saccharide-free concanavalin A MP Blakeley, AJ Kalb, JR Helliwell, DAA Myles Proceedings of the National Academy of Sciences 101 (47), 16405-16410, 2004 | 87 | 2004 |
Covalent narlaprevir- and boceprevir-derived hybrid inhibitors of SARS-CoV-2 main protease DW Kneller, H Li, G Phillips, KL Weiss, Q Zhang, MA Arnould, CB Jonsson, ... Nature Communications 13 (1), 2268, 2022 | 85 | 2022 |
Joint X-ray/neutron crystallographic study of HIV-1 protease with clinical inhibitor amprenavir: Insights for drug design IT Weber, MJ Waltman, M Mustyakimov, MP Blakeley, DA Keen, ... Journal of Medicinal Chemistry 56 (13), 5631-5635, 2013 | 75 | 2013 |
Direct visualization of a Fe(IV)–OH intermediate in a heme enzyme H Kwon, J Basran, CM Casadei, AJ Fielding, TE Schrader, A Ostermann, ... Nature Communications 7, 13445, 2016 | 74 | 2016 |
Identification of the elusive hydronium ion exchanging roles with a proton in an enzyme at lower pH values AY Kovalevsky, BL Hanson, SA Mason, T Yoshida, SZ Fisher, ... Angewandte Chemie International Edition 50 (33), 7520-7523, 2011 | 70 | 2011 |
Near‐atomic resolution neutron crystallography on perdeuterated Pyrococcus furiosus rubredoxin: Implication of hydronium ions and protonation state equilibria in redox changes MG Cuypers, SA Mason, MP Blakeley, EP Mitchell, M Haertlein, ... Angewandte Chemie International Edition 52 (3), 1022-1025, 2013 | 67 | 2013 |
Direct visualization of critical hydrogen atoms in a pyridoxal 5′-phosphate enzyme S Dajnowicz, RC Johnston, JM Parks, MP Blakeley, DA Keen, KL Weiss, ... Nature Communications 8, 955, 2017 | 66 | 2017 |
New sources and instrumentation for neutrons in biology SCM Teixeira, G Zaccai, J Ankner, MC Bellissent-Funel, R Bewley, ... Chemical Physics 345 (2), 133-151, 2008 | 65 | 2008 |
Long‐range electrostatics‐induced two‐proton transfer captured by neutron crystallography in an enzyme catalytic site O Gerlits, T Wymore, A Das, CH Shen, JM Parks, JC Smith, KL Weiss, ... Angewandte Chemie International Edition 55 (16), 4924-4927, 2016 | 60 | 2016 |