| 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 |
| Viral macrodomains: a structural and evolutionary assessment of the pharmacological potential JGM Rack, V Zorzini, Z Zhu, M Schuller, D Ahel, I Ahel Open biology 10 (11), 200237, 2020 | 60 | 2020 |
| Iterative computational design and crystallographic screening identifies potent inhibitors targeting the Nsp3 macrodomain of SARS-CoV-2 S Gahbauer, GJ Correy, M Schuller, MP Ferla, YU Doruk, M Rachman, ... Proceedings of the National Academy of Sciences 120 (2), e2212931120, 2023 | 49 | 2023 |
| Structural insights into the MMACHC-MMADHC protein complex involved in vitamin B12 trafficking DS Froese, J Kopec, F Fitzpatrick, M Schuller, TJ McCorvie, R Chalk, ... Journal of Biological Chemistry 290 (49), 29167-29177, 2015 | 46 | 2015 |
| Molecular basis for DarT ADP-ribosylation of a DNA base M Schuller, RE Butler, A Ariza, C Tromans-Coia, G Jankevicius, ... Nature 596 (7873), 597-602, 2021 | 41 | 2021 |
| Discovery of a selective allosteric inhibitor targeting macrodomain 2 of polyadenosine-diphosphate-ribose polymerase 14 M Schuller, K Riedel, I Gibbs-Seymour, K Uth, C Sieg, AP Gehring, I Ahel, ... ACS chemical biology 12 (11), 2866-2874, 2017 | 39 | 2017 |
| Exploring protein hotspots by optimized fragment pharmacophores D Bajusz, WS Wade, G Satała, AJ Bojarski, J Ilaš, J Ebner, F Grebien, ... Nature Communications 12 (1), 3201, 2021 | 36 | 2021 |
| Discovery of a novel allosteric inhibitor scaffold for polyadenosine-diphosphate-ribose polymerase 14 (PARP14) macrodomain 2 M Moustakim, K Riedel, M Schuller, AP Gehring, OP Monteiro, SP Martin, ... Bioorganic & medicinal chemistry 26 (11), 2965-2972, 2018 | 29 | 2018 |
| Beyond protein modification: the rise of non-canonical ADP-ribosylation M Schuller, I Ahel Biochemical Journal 479 (4), 463-477, 2022 | 22 | 2022 |
| Updated protein domain annotation of the PARP protein family sheds new light on biological function MJ Suskiewicz, D Munnur, Ø Strømland, JC Yang, LE Easton, C Chatrin, ... Nucleic Acids Research 51 (15), 8217-8236, 2023 | 18 | 2023 |
| Modular antibodies reveal DNA damage-induced mono-ADP-ribosylation as a second wave of PARP1 signaling EJ Longarini, H Dauben, C Locatelli, AR Wondisford, R Smith, C Muench, ... Molecular Cell 83 (10), 1743-1760. e11, 2023 | 15 | 2023 |
| Simultaneous Multiple MS Binding Assays Addressing D1 and D2 Dopamine Receptors M Schuller, G Höfner, KT Wanner ChemMedChem 12 (19), 1585-1594, 2017 | 14 | 2017 |
| PARP14 is a PARP with both ADP-ribosyl transferase and hydrolase activities N Đukić, Ø Strømland, JD Elsborg, D Munnur, K Zhu, M Schuller, ... Science Advances 9 (37), eadi2687, 2023 | 11 | 2023 |
| Molecular basis for the reversible ADP-ribosylation of guanosine bases M Schuller, R Raggiaschi, P Mikolcevic, JGM Rack, A Ariza, YG Zhang, ... Molecular Cell 83 (13), 2303-2315. e6, 2023 | 8 | 2023 |
| Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Sci Adv. 2021; 7 (16) M Schuller, GJ Correy, S Gahbauer, D Fearon, T Wu, RE Diaz, ID Young, ... DOI: https://doi. org/10.1126/sciadv. abf8711. PMID: https://www. ncbi. nlm …, 0 | 5 | |
| Discovery and Development Strategies for SARS-CoV-2 NSP3 Macrodomain Inhibitors M Schuller, T Zarganes-Tzitzikas, J Bennett, S De Cesco, D Fearon, ... Pathogens 12 (2), 324, 2023 | 3 | 2023 |
| Structure-based inhibitor optimization for the Nsp3 Macrodomain of SARS-CoV-2. S Gahbauer, GJ Correy, M Schuller, MP Ferla, YU Doruk, M Rachman, ... Biorxiv: the Preprint Server for Biology, 2022 | 3 | 2022 |
| Streptomyces coelicolor macrodomain hydrolase SCO6735 cleaves thymidine-linked ADP-ribosylation of DNA A Hloušek-Kasun, P Mikolčević, JGM Rack, C Tromans-Coia, M Schuller, ... Computational and structural biotechnology journal 20, 4337-4350, 2022 | 2 | 2022 |
| Fragment-Based Hit Discovery via Unsupervised Learning of Fragment-Protein Complexes W McCorkindale, I Ahel, H Barr, GJ Correy, JS Fraser, N London, ... bioRxiv, 2022.11. 21.517375, 2022 | 1 | 2022 |
| Specificity of DNA ADP-Ribosylation Reversal by NADARs B Cihlova, Y Lu, A Mikoč, M Schuller, I Ahel Toxins 16 (5), 208, 2024 | | 2024 |
