| 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 | 220 | 2020 |
| 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 | 116 | 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 | 102 | 2023 |
| 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 | 52 | 2020 |
| 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 | 51 | 2021 |
| 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 | 25 | 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 | 22 | 2023 |
| Activation energies for two steps in the S2→ S3 transition of photosynthetic water oxidation from time-resolved single-frequency infrared spectroscopy SM Mäusle, A Abzaliyeva, P Greife, PS Simon, R Perez, Y Zilliges, H Dau The Journal of Chemical Physics 153 (21), 2020 | 22 | 2020 |
| 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 |
| Room temperature XFEL crystallography reveals asymmetry in the vicinity of the two phylloquinones in photosystem I SM Keable, A Kölsch, PS Simon, M Dasgupta, R Chatterjee, ... Scientific reports 11 (1), 21787, 2021 | 17 | 2021 |
| In situ structural observation of a substrate-and peroxide-bound high-spin ferric-hydroperoxo intermediate in the P450 enzyme CYP121 RC Nguyen, I Davis, M Dasgupta, Y Wang, PS Simon, A Butryn, H Makita, ... Journal of the American Chemical Society 145 (46), 25120-25133, 2023 | 13 | 2023 |
| Effects of x-ray free-electron laser pulse intensity on the Mn Kβ1, 3 x-ray emission spectrum in photosystem II—a case study for metalloprotein crystals and solutions T Fransson, R Alonso-Mori, R Chatterjee, MH Cheah, M Ibrahim, ... Structural Dynamics 8 (6), 2021 | 13 | 2021 |
| Structure of a ribonucleotide reductase R2 protein radical H Lebrette, V Srinivas, J John, O Aurelius, R Kumar, D Lundin, ... Science 382 (6666), 109-113, 2023 | 12 | 2023 |
| XFEL serial crystallography reveals the room temperature structure of methyl-coenzyme M reductase CJ Ohmer, M Dasgupta, A Patwardhan, I Bogacz, C Kaminsky, MD Doyle, ... Journal of inorganic biochemistry 230, 111768, 2022 | 12 | 2022 |
| Going around the Kok cycle of the water oxidation reaction with femtosecond X-ray crystallography A Bhowmick, PS Simon, I Bogacz, R Hussein, M Zhang, H Makita, ... IUCrJ 10 (6), 2023 | 11 | 2023 |
| Redox-controlled reorganization and flavin strain within the ribonucleotide reductase R2b–NrdI complex monitored by serial femtosecond crystallography J John, O Aurelius, V Srinivas, P Saura, IS Kim, A Bhowmick, PS Simon, ... Elife 11, e79226, 2022 | 9 | 2022 |
| Combining on-line spectroscopy with synchrotron and X-ray free electron laser crystallography. H Makita, P Simon, J Kern, J Yano, V Yachandra | 6 | 2023 |
| Combining on-line spectroscopy with synchrotron and x-ray free electron laser crystallography H Makita, PS Simon, J Kern, J Yano, VK Yachandra Current opinion in structural biology 80, 102604, 2023 | 6 | 2023 |
| Tracking the first electron transfer step at the donor side of oxygen-evolving photosystem II by time-resolved infrared spectroscopy MY Dekmak, SM Mäusle, J Brandhorst, PS Simon, H Dau Photosynthesis Research, 1-17, 2023 | 3 | 2023 |
| Room temperature X-ray absorption spectroscopy of metalloenzymes with drop-on-demand sample delivery at XFELs I Bogacz, H Makita, PS Simon, M Zhang, MD Doyle, R Chatterjee, ... Pure and Applied Chemistry 95 (8), 891-897, 2023 | 3 | 2023 |
