Untangling the sequence of events during the S2 → S3 transition in photosystem II and implications for the water oxidation mechanism M Ibrahim, T Fransson, R Chatterjee, MH Cheah, R Hussein, L Lassalle, ... Proceedings of the National Academy of Sciences 117 (23), 12624-12635, 2020 | 212 | 2020 |
Finding our way in the dark proteome A Bhowmick, DH Brookes, SR Yost, HJ Dyson, JD Forman-Kay, D Gunter, ... Journal of the American Chemical Society 138 (31), 9730-9742, 2016 | 128 | 2016 |
Structural dynamics in the water and proton channels of photosystem II during the S2 to S3 transition R Hussein, M Ibrahim, A Bhowmick, PS Simon, R Chatterjee, L Lassalle, ... Nature communications 12 (1), 6531, 2021 | 106 | 2021 |
Structural evidence for intermediates during O2 formation in photosystem II A Bhowmick, R Hussein, I Bogacz, PS Simon, M Ibrahim, R Chatterjee, ... Nature 617 (7961), 629-636, 2023 | 91 | 2023 |
The Importance of the Scaffold for de Novo Enzymes: A Case Study with Kemp Eliminase A Bhowmick, SC Sharma, T Head-Gordon Journal of the American Chemical Society 139 (16), 5793-5800, 2017 | 75 | 2017 |
Chemical crystallography by serial femtosecond X-ray diffraction EA Schriber, DW Paley, R Bolotovsky, DJ Rosenberg, RG Sierra, A Aquila, ... Nature 601 (7893), 360-365, 2022 | 66 | 2022 |
An on-demand, drop-on-drop method for studying enzyme catalysis by serial crystallography A Butryn, PS Simon, P Aller, P Hinchliffe, RN Massad, G Leen, CL Tooke, ... Nature communications 12 (1), 4461, 2021 | 49 | 2021 |
High-resolution XFEL structure of the soluble methane monooxygenase hydroxylase complex with its regulatory component at ambient temperature in two oxidation states V Srinivas, R Banerjee, H Lebrette, JC Jones, O Aurelius, IS Kim, ... Journal of the American Chemical Society 142 (33), 14249-14266, 2020 | 48 | 2020 |
Comparing serial X-ray crystallography and microcrystal electron diffraction (MicroED) as methods for routine structure determination from small macromolecular crystals AM Wolff, ID Young, RG Sierra, AS Brewster, MW Martynowycz, E Nango, ... IUCrJ 7 (2), 306-323, 2020 | 45 | 2020 |
X-ray free-electron laser studies reveal correlated motion during isopenicillin N synthase catalysis P Rabe, JJAG Kamps, KD Sutherlin, JDS Linyard, P Aller, CC Pham, ... Science Advances 7 (34), eabh0250, 2021 | 39 | 2021 |
The role of side chain entropy and mutual information for improving the de novo design of Kemp eliminases KE07 and KE70 A Bhowmick, SC Sharma, H Honma, T Head-Gordon Physical Chemistry Chemical Physics 18 (28), 19386-19396, 2016 | 33 | 2016 |
Mapping protein dynamics at high spatial resolution with temperature-jump X-ray crystallography AM Wolff, E Nango, ID Young, AS Brewster, M Kubo, T Nomura, ... Nature chemistry 15 (11), 1549-1558, 2023 | 29 | 2023 |
A monte carlo method for generating side chain structural ensembles A Bhowmick, T Head-Gordon Structure 23 (1), 44-55, 2015 | 27 | 2015 |
Photoreversible interconversion of a phytochrome photosensory module in the crystalline state ES Burgie, JA Clinger, MD Miller, AS Brewster, P Aller, A Butryn, FD Fuller, ... Proceedings of the National Academy of Sciences 117 (1), 300-307, 2020 | 26 | 2020 |
Processing serial crystallographic data from XFELs or synchrotrons using the cctbx. xfel GUI AS Brewster, ID Young, A Lyubimov, A Bhowmick, NK Sauter Computational Crystallography Newsletter 10, 22-39, 2019 | 24 | 2019 |
Evolutionary diversity of proton and water channels on the oxidizing side of photosystem II and their relevance to function R Hussein, M Ibrahim, A Bhowmick, PS Simon, I Bogacz, MD Doyle, ... Photosynthesis Research 158 (2), 91-107, 2023 | 20 | 2023 |
Water networks in photosystem II using crystalline molecular dynamics simulations and room-temperature XFEL serial crystallography MD Doyle, A Bhowmick, DC Wych, L Lassalle, PS Simon, J Holton, ... Journal of the American Chemical Society 145 (27), 14621-14635, 2023 | 20 | 2023 |
SAD phasing of XFEL data depends critically on the error model AS Brewster, A Bhowmick, R Bolotovsky, D Mendez, PH Zwart, NK Sauter Acta Crystallographica Section D: Structural Biology 75 (11), 959-968, 2019 | 18 | 2019 |
Capturing the sequence of events during the water oxidation reaction in photosynthesis using XFELs PS Simon, H Makita, I Bogacz, F Fuller, A Bhowmick, R Hussein, ... FEBS letters 597 (1), 30-37, 2023 | 17 | 2023 |
Gold Standard for macromolecular crystallography diffraction data HJ Bernstein, A Förster, A Bhowmick, AS Brewster, S Brockhauser, ... IUCrJ 7 (5), 784-792, 2020 | 16 | 2020 |