These publications are based on data gathered on beamline I04-1. If you are aware of any errors or publications that should be listed here, please send details to [email protected].
Structure-guided drug design of novel antibiotics targeting DNA gyrase Harry Morgan
May 2026 Thesis I04-1-Macromolecular Crystallography (fixed wavelength) I23-Long wavelength MX I24-Microfocus Macromolecular Crystallography VMXm-Versatile Macromolecular Crystallography microfocus
Induced circular dichroism from the binding of achiral bivalent ligands to transthyretin Stephen Wood, Yiwei Guan, James Pitts, Raj Gill, Simon Kolstoe, Tamas Javorfi, Rohanah Hussain, Giuliano Siligardi
Journal Of Molecular Recognition, 39 May 2026 DOI: 10.1002/jmr.70037 Journal Paper B23-Circular Dichroism I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) open access Fragment-based design of targeted covalent inhibitors: the scope and limitation of linking approaches Levente Kollár, Levente M. Mihalovits, Dávid Bajusz, Damijan Knez, József Simon, Blake H. Balcomb, Daren Fearon, Stanislav Gobec, György M. Keserű
Chemmedchem, 21 May 2026 DOI: 10.1002/cmdc.202501108 Journal Paper I04-1-Macromolecular Crystallography (fixed wavelength) open access Targeting a pleckstrin homology domain with a lysine-reactive covalent binder Rebekah M. West, Radu Costin Bizga Nicolescu, Paul Brear, James Wagstaff, Beata K. Blaszczyk, Tomas Deingruber, Matthew G. Sanders, Francisco Javier Pérez-Areales, David R. Spring, Marko Hyvonen
Journal Of Medicinal Chemistry, May 2026 DOI: 10.1021/acs.jmedchem.5c03818 Journal Paper I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) I04-Macromolecular Crystallography open access Modulation of VHL binding affinity improves selectivity of PROTACs targeting BRM (SMARCA2) over BRG1 (SMARCA4) Michael Berlin, Jennifer Cantley, Fabio Broccatelli, Lin Cao, Huifen Chen, Tommy K. Cheung, Andrew P. Crew, Dean Dinicola, Hanqing Dong, Matthew Grimmer, Brian D. Hamman, Alicia Harbin, Mingtao He, Xiuxian Hu, Alison J. Hole, Thomas Januario, Philip S. Kerry, Xiangjia Liu, Connor Quinn, Christopher M. Rose, Emma Rousseau, Lawrence B. Snyder, Leanna R. Staben, Gan Wang, Jing Wang, Xiaofen Ye, Robert L. Yauch, Peter S. Dragovich
Results In Chemistry, 24 May 2026 DOI: 10.1016/j.rechem.2026.103211 Journal Paper I04-1-Macromolecular Crystallography (fixed wavelength) open access Towards the targeted protein degradation of CK2: design and synthesis of CAM4066-based PROTACs Sophie Day-Riley, Sona Krajcovicova, Aryaman Raj Sokhal, Jan L Venne, Paul Brear, Marko Hyvonen, Benjamin C Whitehurst, Jason S Carroll, David R Spring
Beilstein Journal Of Organic Chemistry, 22 Apr 2026 DOI: 10.3762/bjoc.22.47 Journal Paper I04-1-Macromolecular Crystallography (fixed wavelength) open access A synergistic inhibitor development strategy against human UDP-galactose-4-epimerase William M. Browne, Jonathan Pettinger, Teresa Weckwerth, Andrew Purkiss, Sing Hei Lok, Louisa Penicaut, Roksana Ogrodowicz, Raveena Prema, Simone Kunzelmann, Chloe Roustan, Ganka Bineva‐todd, Saskia Pieters, Francesca Zappacosta, Alfred E. Doherty, Isobel Oram, Christelle Soudy, Robert Quinlan, Joanna Redmond, Svend Kjaer, David House, Stephane Mouilleron, Jacob T. Bush, Benjamin Schumann
Angewandte Chemie International Edition, 126 Apr 2026 DOI: 10.1002/anie.202520304 Journal Paper I04-1-Macromolecular Crystallography (fixed wavelength) open access A major histocompatibility complex (MHC) class II molecule that binds the same viral pathogen peptide with both nonamer and decamer core sequences for presentation to T cells Anastasia Goryanin, Atlanta G. Cook, Shahriar Behboudi, Jim Kaufman, Samer Halabi
Journal Of Virology, 25 Apr 2026 DOI: 10.1128/jvi.01859-25 Journal Paper I04-1-Macromolecular Crystallography (fixed wavelength) open access The human TIMP-1 unbound structure provides a platform for fragment screening Ahmed Shemy, Jana Van Broeckhoven, Niels Hellings, Arnout Voet
Acta Crystallographica Section D Structural Biology, 82 Apr 2026 DOI: 10.1107/S2059798326001749 Journal Paper I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) Discovery and characterization of novel 2-phosphoglycerate kinase and cyclic 2,3-diphosphoglycerate synthase from thermophilic (meta)genomes Stefania Patti, Simone A. De Rose, Michail N. Isupov, Ilya V. Kublanov, Ilaria Magrini Alunno, Sergio Riva, Ivan Bassanini, Eleonora Dore, Christina Stracke, Bettina Siebers, Erica Elisa Ferrandi, Jennifer A. Littlechild, Daniela Monti
Catalysts, 16 Apr 2026 DOI: 10.3390/catal16040305 Journal Paper I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) I04-Macromolecular Crystallography open access Structure-guided design of a PfCyRPA-based vaccine against blood-stage malaria Nawsad Alam, Clare Wolfle, Egle Butkeviciute, Doris Quinkert, Lloyd D. W. King, Matthew K. Higgins
Embo Molecular Medicine, 18 Mar 2026 DOI: 10.1038/s44321-026-00376-x Journal Paper I04-1-Macromolecular Crystallography (fixed wavelength) open access Workflow for crystallographic fragment screening by crystal soaking for protein targets: a case study on thioredoxin glutathione reductase from Schistosoma mansoni Lauro Neto, Bogar Montoya, Jose Brandao-Neto, Kelly Parker, Frank Von Delft, Nicholas Furnham, Raymond Owens, Floriano Silva-Jr
Bio-Protocol, 16 Mar 2026 DOI: 10.21769/BioProtoc.5651 Journal Paper I04-1-Macromolecular Crystallography (fixed wavelength) open access The single septin from Chlamydomonas reinhardtii reveals a polyproline II helix-based NC-interface as an ancestral scaffold for filament assembly Bryan Marquez, Diego Antonio Leonardo, Eloy Condori, Andressa Alves Pinto, Gabriel Brognara, Adriano Alves Furtado, Humberto D'Muniz Pereira, Richard Charles Garratt, Ana Paula Ulian Araujo
Journal Of Molecular Biology, 13 Mar 2026 DOI: 10.1016/j.jmb.2026.169757 Journal Paper I04-1-Macromolecular Crystallography (fixed wavelength) VMXm-Versatile Macromolecular Crystallography microfocus open access Utilizing constrained bicyclic peptides for in vitro diagnostics André Shamsabadi, Adam Creamer, Christy J. Sadler, Aida Abdelwahed, Katherine U. Gaynor, Yuliya Demydchuk, Gabriela Ivanova-Berndt, Katerine Van Rietschoten, Paul Beswick, Liuhong Chen, Gustavo Arruda Bezerra, Aleksei Lulla, Paul Brear, Marko Hyvonen, Michael J. Skynner, Molly M. Stevens
Acs Nano, Feb 2026 DOI: 10.1021/acsnano.5c19041 Journal Paper I04-1-Macromolecular Crystallography (fixed wavelength) I04-Macromolecular Crystallography open access