Bacteriophage PRD1 as a nanoscaffold for drug loading Helen M. E. Duyvesteyn, Isaac Santos-Perez, Francesca Peccati, Ane Martinez-Castillo, Thomas S. Walter, David Reguera, Felix M. Goñi, Gonzalo Jiménez-Osés, Hanna M. Oksanen, David I. Stuart, Nicola G. A. Abrescia
Nanoscale, 156 Dec 2021 DOI: 10.1039/D1NR04153C Journal Paper I24-Microfocus Macromolecular Crystallography open access Structure-guided approach to relieving transcriptional repression in resistance to thyroid hormone α Beatriz Romartinez-Alonso, Maura Agostini, Heulyn Jones, Jayde Mclellan, Deepali Sood, Nicholas Tomkinson, Federica Marelli, Ilaria Gentile, W. Edward Visser, Erik Schoenmakers, Louise Fairall, Martin Privalsky, Carla Moran, Luca Persani, Krishna Chatterjee, John Schwabe
Molecular And Cellular Biology, 3 Dec 2021 DOI: 10.1128/MCB.00363-21 Journal Paper I24-Microfocus Macromolecular Crystallography open access Insights into the mechanism of high lipid–detergent crystallization of membrane proteins Sofia Trampari, Caroline Neumann, Samuel J. Hjorth-Jensen, Azadeh Shahsavar, Esben M. Quistgaard, Poul Nissen
Journal Of Applied Crystallography, 54 Dec 2021 DOI: 10.1107/S1600576721010669 Hedgehog-Interacting Protein is a multimodal antagonist of Hedgehog signalling Samuel C. Griffiths, Rebekka A. Schwab, Kamel El Omari, Benjamin Bishop, Ellen J. Iverson, Tomas Malinauskas, Ramin Dubey, Mingxing Qian, Douglas F. Covey, Robert J. C. Gilbert, Rajat Rohatgi, Christian Siebold
Nature Communications, 12 Dec 2021 DOI: 10.1038/s41467-021-27475-2 Journal Paper I03-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Structure-guided discovery of aminoquinazolines as brain-penetrant and selective LRRK2 inhibitors Mitchell H. Keylor, Anmol Gulati, Solomon D. Kattar, Rebecca E. Johnson, Ryan W. Chau, Kaila A. Margrey, Michael J. Ardolino, Cayetana Zarate, Kelsey E. Poremba, Vladimir Simov, Gregori J. Morriello, John J. Acton, Barbara Pio, Xin Yan, Rachel L. Palte, Spencer E. Mcminn, Lisa Nogle, Charles A. Lesburg, Donovon Adpressa, Shishi Lin, Santhosh Neelamkavil, Ping Liu, Jing Su, Laxminarayan G. Hegde, Janice D. Woodhouse, Robert Faltus, Tina Xiong, Paul J. Ciaccio, Jennifer Piesvaux, Karin M. Otte, Harold B. Wood, Matthew E. Kennedy, David Jonathan Bennett, Erin F. Dimauro, Matthew J. Fell, Peter H. Fuller
Journal Of Medicinal Chemistry, 365 Dec 2021 DOI: 10.1021/acs.jmedchem.1c01968 The human gut symbiont Ruminococcus gnavus shows specificity to blood group A antigen during mucin glycan foraging: Implication for niche colonisation in the gastrointestinal tract Haiyang Wu, Emmanuelle H. Crost, C. David Owen, Wouter Van Bakel, Ana Martínez Gascueña, Dimitrios Latousakis, Thomas Hicks, Samuel Walpole, Paulina A. Urbanowicz, Didier Ndeh, Serena Monaco, Laura Sánchez Salom, Ryan Griffiths, Raven S. Reynolds, Anna Colvile, Daniel I. R. Spencer, Martin Walsh, Jesus Angulo, Nathalie Juge
Plos Biology, 19 Dec 2021 DOI: 10.1371/journal.pbio.3001498 Journal Paper I03-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography VMXi-Versatile Macromolecular Crystallography in situ open access Human enzyme identified as potential key to treating lung and bladder cancer – increasing survival times Diamond Light Source
Dec 2021 Science Highlight I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) I24-Microfocus Macromolecular Crystallography
Experimental evidence for the benefits of higher X-ray energies for macromolecular crystallography Selina L. S. Storm, Danny Axford, Robin L. Owen
Iucrj, 8 Nov 2021 DOI: 10.1107/S2052252521008423 Journal Paper I24-Microfocus Macromolecular Crystallography open access The importance of adaptor proteins and cell signalling in the control of peptidoglycan synthesis Zoe Jane Rutter
Nov 2021 Thesis I03-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography
From structure to clinic: Design of a muscarinic M1 receptor agonist with potential to treatment of Alzheimer’s disease Alastair J. H. Brown, Sophie J. Bradley, Fiona H. Marshall, Giles A. Brown, Kirstie A. Bennett, Jason Brown, Julie E. Cansfield, David M. Cross, Chris De Graaf, Brian D. Hudson, Louis Dwomoh, João M. Dias, James C. Errey, Edward Hurrell, Jan Liptrot, Giulio Mattedi, Colin Molloy, Pradeep J. Nathan, Krzysztof Okrasa, Greg Osborne, Jayesh C. Patel, Mark Pickworth, Nathan Robertson, Shahram Shahabi, Christoffer Bundgaard, Keith Phillips, Lisa M. Broad, Anushka V. Goonawardena, Stephen R. Morairty, Michael Browning, Francesca Perini, Gerard R. Dawson, John F. W. Deakin, Robert T. Smith, Patrick M. Sexton, Julie Warneck, Mary Vinson, Tim Tasker, Benjamin G. Tehan, Barry Teobald, Arthur Christopoulos, Christopher J. Langmead, Ali Jazayeri, Robert M. Cooke, Prakash Rucktooa, Miles S. Congreve, Malcolm Weir, Andrew B. Tobin
Cell, 184 Nov 2021 DOI: 10.1016/j.cell.2021.11.001 Structure-based design of selective fat mass and obesity associated protein (FTO) inhibitors Shifali Shishodia, Marina Demetriades, Dong Zhang, Nok Yin Tam, Pratheesh Maheswaran, Caitlin Clunie-O'Connor, Anthony Tumber, Ivanhoe K. H. Leung, Yi Min Ng, Thomas M. Leissing, Afaf H. El-Sagheer, Eidarus Salah, Tom Brown, Wei Shen Aik, Michael A. Mcdonough, Christopher J. Schofield
Journal Of Medicinal Chemistry, 276 Nov 2021 DOI: 10.1021/acs.jmedchem.1c01204 Journal Paper I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Kinetic and structural properties of a robust bacterial L-amino acid oxidase Simone Savino, J. Daniël-Moráh Meijer, Henriëtte J. Rozeboom, Hugo L. Van Beek, Marco W. Fraaije
Catalysts, 11 Nov 2021 DOI: 10.3390/catal11111309 Journal Paper I24-Microfocus Macromolecular Crystallography open access Structural basis of Apt48 inhibition of the BCL6 BTB domain Thomas Zacharchenko, Arnout P. Kalverda, Stephanie C. Wright
Structure, 66 Nov 2021 DOI: 10.1016/j.str.2021.10.010 Acquisition of ionic copper by the bacterial outer membrane protein OprC through a novel binding site Satya Prathyusha Bhamidimarri, Tessa R. Young, Muralidharan Shanmugam, Sandra Soderholm, Arnaud Basle, Dirk Bumann, Bert Van Den Berg
Plos Biology, 19 Nov 2021 DOI: 10.1371/journal.pbio.3001446 Journal Paper I02-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access The structural basis for high affinity binding of α1-acid glycoprotein to the potent anti-tumour compound UCN-01 Erik J. B. Landin, Christopher Williams, Sara A. Ryan, Alice Bochel, Akter Nahida, Christina Redfield, Richard B. Sessions, Neesha Dedi, Richard Taylor, Matthew P. Crump
Journal Of Biological Chemistry, 12 Nov 2021 DOI: 10.1016/j.jbc.2021.101392 Journal Paper I24-Microfocus Macromolecular Crystallography open access Kinetic and structural characterization of sialidases (Kdnases) from ascomycete fungal pathogens Ali Nejatie, Elizabeth Steves, Nick Gauthier, Jamie Baker, Jason Nesbitt, Stephen A. Mcmahon, Verena Oehler, Nicholas J. Thornton, Benjamin Noyovitz, Kobra Khazaei, Brock W. Byers, Wesley F. Zandberg, Tracey M. Gloster, Margo M. Moore, Andrew J. Bennet
Acs Chemical Biology, 16 Nov 2021 DOI: 10.1021/acschembio.1c00666 Journal Paper I04-1-Macromolecular Crystallography (fixed wavelength) I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography Crystallography and QM/MM simulations identify preferential binding of hydrolyzed carbapenem and penem antibiotics to the l1 metallo-β-lactamase in the imine form Rebecca M. Twidale, Philip Hinchliffe, James Spencer, Adrian J. Mulholland
Journal Of Chemical Information And Modeling, Oct 2021 DOI: 10.1021/acs.jcim.1c00663 The phage defence island of a multidrug resistant plasmid uses both BREX and type IV restriction for complementary protection from viruses David M. Picton, Yvette A. Luyten, Richard D. Morgan, Darren L. Smith, David T. F. Dryden, Jay C. D. Hinton, Tim R. Blower
Nucleic Acids Research, Oct 2021 DOI: 10.1093/nar/gkab906 Journal Paper I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access A single sulfatase is required to access colonic mucin by a gut bacterium Ana S. Luis, Chunsheng Jin, Gabriel Vasconcelos Pereira, Robert W. P. Glowacki, Sadie R. Gugel, Shaleni Singh, Dominic P. Byrne, Nicholas A. Pudlo, James A. London, Arnaud Basle, Mark Reihill, Stefan Oscarson, Patrick A. Eyers, Mirjam Czjzek, Gurvan Michel, Tristan Barbeyron, Edwin A. Yates, Gunnar C. Hansson, Niclas G. Karlsson, Alan Cartmell, Eric C. Martens
Nature, 105 Oct 2021 DOI: 10.1038/s41586-021-03967-5 Journal Paper I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Investigating the mechanism through which amino acids activate a conserved serine/threonine protein kinase in Actinobacteria Zacchaeus Newland-Smith
Oct 2021 Thesis I03-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography
Structural basis for silicic acid uptake by higher plants Bert Van Den Berg, Conrado Pedebos, Jani R. Bolla, Carol V. Robinson, Arnaud Basle, Syma Khalid
Journal Of Molecular Biology, 433 Oct 2021 DOI: 10.1016/j.jmb.2021.167226 Journal Paper I24-Microfocus Macromolecular Crystallography open access Structural and evolutionary analyses of PR-4 SUGARWINs points to a different pattern of protein function Lorhenn Bryanda Lemes Maia, Humberto D'Muniz Pereira, Richard C. Garratt, Jose Brandao-Neto, Flavio Henrique-Silva, Danyelle Toyama, Renata O. Dias, José Fernando Ruggiero Bachega, Julia Vasconcellos Peixoto, Marcio C. Silva-Filho
Frontiers In Plant Science, 12 Sept 2021 DOI: 10.3389/fpls.2021.734248 Journal Paper I24-Microfocus Macromolecular Crystallography open access Substrate specificity and conformational flexibility properties of the Mycobacterium tuberculosis β-oxidation trifunctional enzyme Subhadra Dalwani, Outi Lampela, Pierre Leprovost, Werner Schmitz, André H. Juffer, Rik K. Wierenga, Rajaram Venkatesan
Journal Of Structural Biology, 213 Sept 2021 DOI: 10.1016/j.jsb.2021.107776 Journal Paper I02-Macromolecular Crystallography I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Modelling the effects of optical vibrations on photon beam parameters using ray-tracing software C. Houghton, C. Bloomer, L. Alianelli
Journal Of Synchrotron Radiation, 28 Sept 2021 DOI: 10.1107/S1600577521007013 Journal Paper I24-Microfocus Macromolecular Crystallography open access A potent SARS-CoV-2 neutralising nanobody shows therapeutic efficacy in the Syrian golden hamster model of COVID-19 Jiandong Huo, Halina Mikolajek, Audrey Le Bas, Jordan J. Clark, Parul Sharma, Anja Kipar, Joshua Dormon, Chelsea Norman, Miriam Weckener, Daniel K. Clare, Peter J. Harrison, Julia A. Tree, Karen R. Buttigieg, Francisco J. Salguero, Robert Watson, Daniel Knott, Oliver Carnell, Didier Ngabo, Michael J. Elmore, Susan Fotheringham, Adam Harding, Lucile Moynie, Philip N. Ward, Maud Dumoux, Tessa Prince, Yper Hall, Julian A. Hiscox, Andrew Owen, William James, Miles W. Carroll, James P. Stewart, James Naismith, Raymond Owens
Nature Communications, 12 Sept 2021 DOI: 10.1038/s41467-021-25480-z Journal Paper I03-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Molecular mechanism of sugar transport in plants unveiled by structures of glucose/H+ symporter STP10 Laust Bavnhøj, Peter Aasted Paulsen, Jose C. Flores-Canales, Birgit Schiøtt, Bjorn Panyella Pedersen
Nature Plants, 4 Sept 2021 DOI: 10.1038/s41477-021-00992-0 Journal Paper I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography Directed evolution of prenylated FMN-dependent Fdc supports efficient in vivo isobutene production Annica Saaret, Benoît Villiers, François Stricher, Macha Anissimova, Mélodie Cadillon, Reynard Spiess, Sam Hay, David Leys
Nature Communications, 12 Sept 2021 DOI: 10.1038/s41467-021-25598-0 Journal Paper I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Nonhydrolysable analogues of (p)ppGpp and (p)ppApp alarmone nucleotides as novel molecular tools Viktor Mojr, Mohammad Roghanian, Hedvig Tamman, Duy Dinh Do Pham, Magdalena Petrová, Radek Pohl, Hiraku Takada, Katleen Van Nerom, Hanna Ainelo, Julien Caballero-Montes, Steffi Jimmy, Abel Garcia-Pino, Vasili Hauryliuk, Dominik Rejman
Acs Chemical Biology, 3 Sept 2021 DOI: 10.1021/acschembio.1c00398 Structure of the human marker of self 5-transmembrane receptor CD47 Gustavo Fenalti, Nicolas Villanueva, Mark Griffith, Barbra Pagarigan, Sirish Kaushik Lakkaraju, Richard Y.-C. Huang, Nadia Ladygina, Alok Sharma, David Mikolon, Mahan Abbasian, Jeffrey Johnson, Haralambos Hadjivassiliou, Dan Zhu, Philip P. Chamberlain, Ho Cho, Kandasamy Hariharan
Nature Communications, 12 Sept 2021 DOI: 10.1038/s41467-021-25475-w Journal Paper I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Aspartate or arginine? Validated redox state X-ray structures elucidate mechanistic subtleties of FeIV = O formation in bacterial dye-decolorizing peroxidases Marina Lucic, Michael T. Wilson, Dimitri A. Svistunenko, Robin L. Owen, Michael A. Hough, Jonathan A. R. Worrall
Jbic Journal Of Biological Inorganic Chemistry, 65 Sept 2021 DOI: 10.1007/s00775-021-01896-2 Journal Paper I24-Microfocus Macromolecular Crystallography open access Cooperative stabilisation of 14-3-3σ protein–protein interactions via covalent protein modification Marta Falcicchio, Jake A. Ward, Sara Y. Chothia, Jaswir Basran, Alisha Mohindra, Salvador Macip, Pietro Roversi, Richard G. Doveston
Chemical Science, 61 Sept 2021 DOI: 10.1039/D1SC02120F Journal Paper I24-Microfocus Macromolecular Crystallography open access Making molecular movies drop by drop Diamond Light Source
Sept 2021 Science Highlight I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography
X-ray free-electron laser studies reveal correlated motion during isopenicillin N synthase catalysis Patrick Rabe, Jos J. A. G. Kamps, Kyle D. Sutherlin, James D. S. Linyard, Pierre Aller, Cindy C. Pham, Mikako Makita, Ian Clifton, Michael A. Mcdonough, Thomas M. Leissing, Denis Shutin, Pauline A. Lang, Agata Butryn, Jurgen Brem, Sheraz Gul, Franklin D. Fuller, In-Sik Kim, Mun Hon Cheah, Thomas Fransson, Asmit Bhowmick, Iris D. Young, Lee O'Riordan, Aaron S. Brewster, Ilaria Pettinati, Margaret Doyle, Yasumasa Joti, Shigeki Owada, Kensuke Tono, Alexander Batyuk, Mark S. Hunter, Roberto Alonso-Mori, Uwe Bergmann, Robin L. Owen, Nicholas K. Sauter, Timothy D. W. Claridge, Carol V. Robinson, Vittal K. Yachandra, Junko Yano, Jan F. Kern, Allen M. Orville, Christopher J. Schofield
Science Advances, 7 Aug 2021 DOI: 10.1126/sciadv.abh0250 Journal Paper I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access A topological switch in CFTR modulates channel activity and sensitivity to unfolding Daniel Scholl, Maud Sigoillot, Marie Overtus, Rafael Colomer Martinez, Chloé Martens, Yiting Wang, Els Pardon, Toon Laeremans, Abel Garcia-Pino, Jan Steyaert, David N. Sheppard, Jelle Hendrix, Cedric Govaerts
Nature Chemical Biology, 245 Aug 2021 DOI: 10.1038/s41589-021-00844-0 Journal Paper I02-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography The bacterial iron sensor IdeR recognizes its DNA targets by indirect readout Francisco Javier Marcos-Torres, Dirk Maurer, Linda Juniar, Julia J. Griese
Nucleic Acids Research, 25 Aug 2021 DOI: 10.1093/nar/gkab711 Journal Paper I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access UbiD domain dynamics underpins aromatic decarboxylation Stephen A. Marshall, Karl A. P. Payne, Karl Fisher, Gabriel R. Titchiner, Colin Levy, Sam Hay, David Leys
Nature Communications, 12 Aug 2021 DOI: 10.1038/s41467-021-25278-z Journal Paper I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) I24-Microfocus Macromolecular Crystallography open access Molecular basis for DarT ADP-ribosylation of a DNA base Marion Schuller, Rachel E. Butler, Antonio Ariza, Callum Tromans-Coia, Gytis Jankevicius, Tim D. W. Claridge, Sharon L. Kendall, Shan Goh, Graham R. Stewart, Ivan Ahel
Nature, 58 Aug 2021 DOI: 10.1038/s41586-021-03825-4 Journal Paper I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Computational redesign of an ω-transaminase from Pseudomonas jessenii for asymmetric synthesis of enantiopure bulky amines Qinglong Meng, Carlos Ramírez-Palacios, Nikolas Capra, Mattijs E. Hooghwinkel, Sebastian Thallmair, Henriëtte J. Rozeboom, Andy-Mark W. H. Thunnissen, Hein J. Wijma, Siewert J. Marrink, Dick B. Janssen
Acs Catalysis, Aug 2021 DOI: 10.1021/acscatal.1c02053 Journal Paper I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access X-ray molecular structure characterization of a hexamethylenetetramine zinc(II) porphyrin complex, catalytic degradation of toluidine blue dye, experimental and statistical studies of adsorption isotherms J. Brahmi, S. Nasri, C. Briki, M. Guergueb, S. Najmudin, K. Aouadi, M. R. Sanderson, M. Winter, D. Cruickshank, H. Nasri
Journal Of Molecular Liquids, 24 Aug 2021 DOI: 10.1016/j.molliq.2021.117394 Journal Paper I02-Macromolecular Crystallography I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography Structural and mechanistic insights into the Artemis endonuclease and strategies for its inhibition Yuliana Yosaatmadja, Hannah T. Baddock, Joseph A. Newman, Marcin Bielinski, Angeline E. Gavard, Shubhashish M. M. Mukhopadhyay, Adam a. Dannerfjord, Christopher J. Schofield, Peter j. Mchugh, Opher Gileadi
Nucleic Acids Research, 44 Aug 2021 DOI: 10.1093/nar/gkab693 Journal Paper I03-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Kinetoplastid kinetochore proteins KKT2 and KKT3 have unique centromere localization domains Gabriele Marciano, Midori Ishii, Olga O. Nerusheva, Bungo Akiyoshi
Journal Of Cell Biology, 220 Aug 2021 DOI: 10.1083/jcb.202101022 Journal Paper I03-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Structural insight into the unique conformation of cystathionine β-synthase from Toxoplasma gondii Carmen Fernandez-Rodriguez, Iker Oyenarte, Carolina Conter, Irene Gonzalez-Recio, Reyes Núñez-Franco, Claudia Gil-Pitarch, Iban Quintana, Gonzalo Jiménez-Osés, Paola Dominici, Maria Luz Martinez-Chantar, Alessandra Astegno, Luis Alfonso Martinez-Cruz
Computational And Structural Biotechnology Journal, 19 Aug 2021 DOI: 10.1016/j.csbj.2021.05.052 Journal Paper I03-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Structural basis of meiotic chromosome synaptic elongation through hierarchical fibrous assembly of SYCE2-TEX12 James M. Dunce, Lucy J. Salmon, Owen R. Davies
Nature Structural & Molecular Biology, 7 Aug 2021 DOI: 10.1038/s41594-021-00636-z Journal Paper B21-High Throughput SAXS I03-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography Conformational flexibility of a highly conserved helix controls cryptic pocket formation in FtsZ Aisha Alnami, Raymond S. Norton, Helena Perez Pena, Shozeb Haider, Frank Kozielski
Journal Of Molecular Biology, 433 Jul 2021 DOI: 10.1016/j.jmb.2021.167061 Journal Paper I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography The role of membrane destabilisation and protein dynamics in BAM catalysed OMP folding Paul White, Samuel F. Haysom, Matthew G. Iadanza, Anna J. Higgins, Jonathan M. Machin, James M. Whitehouse, Jim E. Horne, Bob Schiffrin, Charlotte Carpenter-Platt, Antonio N. Calabrese, Kelly M. Storek, Steven T. Rutherford, David J. Brockwell, Neil A. Ranson, Sheena E. Radford
Nature Communications, 12 Jul 2021 DOI: 10.1038/s41467-021-24432-x Journal Paper I24-Microfocus Macromolecular Crystallography open access Selection and structural characterization of anti-TREM2 scFvs that reduce levels of shed ectodomain Aleksandra Szykowska, Yu Chen, Thomas B. Smith, Charlotta Preger, Jingjie Yang, Dongming Qian, Shubhashish M. Mukhopadhyay, Edvard Wigren, Stephen J. Neame, Susanne Gräslund, Helena Persson, Peter J. Atkinson, Elena Di Daniel, Emma Mead, John Wang, John B. Davis, Nicola A. Burgess-Brown, Alex N. Bullock
Structure, 62 Jul 2021 DOI: 10.1016/j.str.2021.06.010 Journal Paper I03-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Crystal structure and functional characterization of an oligosaccharide dehydrogenase from Pycnoporus cinnabarinus provides insights into fungal breakdown of lignocellulose Gabriele Cerutti, Elena Gugole, Linda Celeste Montemiglio, Annick Turbé-Doan, Dehbia Chena, David Navarro, Anne Lomascolo, François Piumi, Cécile Exertier, Ida Freda, Beatrice Vallone, Eric Record, Carmelinda Savino, Giuliano Sciara
Biotechnology For Biofuels, 14 Jul 2021 DOI: 10.1186/s13068-021-02003-y Journal Paper I24-Microfocus Macromolecular Crystallography open access Structure of an H3N2 influenza virus nucleoprotein Michael L. Knight, Haitian Fan, David L. V. Bauer, Jonathan M. Grimes, Ervin Fodor, Jeremy Keown
Acta Crystallographica Section F Structural Biology Communications, 77 Jul 2021 DOI: 10.1107/S2053230X2100635X Journal Paper I24-Microfocus Macromolecular Crystallography open access Viruses that defeat microbe immunity could help fight drug-resistant bacteria Tracey M. Gloster, Malcolm White
Jul 2021 Diamond Annual Review Highlight I24-Microfocus Macromolecular Crystallography
Talin mechanosensitivity is modulated by a direct interaction with cyclin-dependent kinase-1 Rosemarie E. Gough, Matthew C. Jones, Thomas Zacharchenko, Shimin Le, Miao Yu, Guillaume Jacquemet, Ste P. Muench, Jie Yan, Jonathan D. Humphries, Claus Jørgensen, Martin J. Humphries, Benjamin T. Goult
Journal Of Biological Chemistry, 297 Jul 2021 DOI: 10.1016/j.jbc.2021.100837 Journal Paper I24-Microfocus Macromolecular Crystallography open access Structural basis of the membrane intramolecular transacylase reaction responsible for lyso-form lipoprotein synthesis Samir Olatunji, Katherine Bowen, Chia-Ying Huang, Dietmar Weichert, Warispreet Singh, Irina G. Tikhonova, Eoin M. Scanlan, Vincent Olieric, Martin Caffrey
Nature Communications, 12 Jul 2021 DOI: 10.1038/s41467-021-24475-0 Journal Paper I24-Microfocus Macromolecular Crystallography open access An on-demand, drop-on-drop method for studying enzyme catalysis by serial crystallography Agata Butryn, Philipp S. Simon, Pierre Aller, Philip Hinchliffe, Ramzi N. Massad, Gabriel Leen, Catherine L. Tooke, Isabel Bogacz, In-Sik Kim, Asmit Bhowmick, Aaron S. Brewster, Nicholas E. Devenish, Jurgen Brem, Jos J. A. G. Kamps, Pauline A. Lang, Patrick Rabe, Danny Axford, John H. Beale, Bradley Davy, Ali Ebrahim, Julien Orlans, Selina L. S. Storm, Tiankun Zhou, Shigeki Owada, Rie Tanaka, Kensuke Tono, Gwyndaf Evans, Robin L. Owen, Frances A. Houle, Nicholas K. Sauter, Christopher J. Schofield, James Spencer, Vittal K. Yachandra, Junko Yano, Jan F. Kern, Allen M. Orville
Nature Communications, 12 Jul 2021 DOI: 10.1038/s41467-021-24757-7 Journal Paper I24-Microfocus Macromolecular Crystallography open access GH18 endo-β-n-acetylglucosaminidases use distinct mechanisms to process hybrid-type n-linked glycans Beatriz Trastoy, Jonathan J. Du, Chao Li, Mikel García-Alija, Erik H. Klontz, Blaine R. Roberts, Thomas C. Donahue, Lai-Xi Wang, Eric J. Sundberg, Marcelo E. Guerin
Journal Of Biological Chemistry, 69 Jul 2021 DOI: 10.1016/j.jbc.2021.101011 Journal Paper I24-Microfocus Macromolecular Crystallography open access Repurposed floxacins targeting RSK4 prevent chemoresistance and metastasis in lung and bladder cancer Stelios Chrysostomou, Rajat Roy, Filippo Prischi, Lucksamon Thamlikitkul, Kathryn L. Chapman, Uwais Mufti, Robert Peach, Laifeng Ding, David Hancock, Christopher Moore, Miriam Molina-Arcas, Francesco Mauri, David J. Pinato, Joel M. Abrahams, Silvia Ottaviani, Leandro Castellano, Georgios Giamas, Jennifer Pascoe, Devmini Moonamale, Sarah Pirrie, Claire Gaunt, Lucinda Billingham, Neil M. Steven, Michael Cullen, David Hrouda, Mathias Winkler, John Post, Philip Cohen, Seth J. Salpeter, Vered Bar, Adi Zundelevich, Shay Golan, Dan Leibovici, Romain Lara, David R. Klug, Sophia N. Yaliraki, Mauricio Barahona, Yulan Wang, Julian Downward, J. Mark Skehel, Maruf M. U. Ali, Michael J. Seckl, Olivier E. Pardo
Science Translational Medicine, 13 Jul 2021 DOI: 10.1126/scitranslmed.aba4627 Journal Paper I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) I24-Microfocus Macromolecular Crystallography Mechanistic insights into the three steps of poly(ADP-ribosylation) reversal Johannes Gregor Matthias Rack, Qiang Liu, Valentina Zorzini, Jim Voorneveld, Antonio Ariza, Kourosh Honarmand Ebrahimi, Julia M. Reber, Sarah C. Krassnig, Dragana Ahel, Gijsbert A. Van Der Marel, Aswin Mangerich, James S. O. Mccullagh, Dmitri V. Filippov, Ivan Ahel
Nature Communications, 12 Jul 2021 DOI: 10.1038/s41467-021-24723-3 Journal Paper I03-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Towards defining mechanisms involved in β-lactam resistance using serial crystallography Anka Lucic
Jul 2021 Thesis I04-1-Macromolecular Crystallography (fixed wavelength) I24-Microfocus Macromolecular Crystallography
Structural and functional characterization of PGRP-LB: modulation of the IMD immune pathway in pathogenic and mutualistic bacterial interactions Julien Orlans
Jul 2021 Thesis I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography
Structure-based optimization and discovery of M3258, a specific inhibitor of the immunoproteasome subunit LMP7 (β5i) Markus Klein, Michael Busch, Manja Friese-Hamim, Stefano Crosignani, Thomas Fuchss, Djordje Musil, Felix Rohdich, Michael P. Sanderson, Jeyaprakashnarayanan Seenisamy, Gina Walter-Bausch, Ugo Zanelli, Philip Hewitt, Christina Esdar, Oliver Schadt
Journal Of Medicinal Chemistry, 64 Jul 2021 DOI: 10.1021/acs.jmedchem.1c00604 Reversible covalent imine-tethering for selective stabilization of 14-3-3 hub protein interactions Peter J. Cossar, Madita Wolter, Lars Van Dijck, Dario Valenti, Laura M. Levy, Christian Ottmann, Luc Brunsveld
Journal Of The American Chemical Society, 143 June 2021 DOI: 10.1021/jacs.1c03035 Journal Paper I03-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access An exploration of chemical properties required for cooperative stabilization of the 14-3-3 interaction with NF-κB—utilizing a reversible covalent tethering approach Madita Wolter, Dario Valenti, Peter J. Cossar, Stanimira Hristeva, Laura M. Levy, Thorsten Genski, Torsten Hoffmann, Luc Brunsveld, Dimitrios Tzalis, Christian Ottmann
Journal Of Medicinal Chemistry, June 2021 DOI: 10.1021/acs.jmedchem.1c00401 Journal Paper I03-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access A fragment-based approach to assess the ligandability of ArgB, ArgC, ArgD and ArgF in the L-arginine biosynthetic pathway of Mycobacterium tuberculosis Pooja Gupta, Sherine E. Thomas, Shaymaa A. Zaidan, Maria A. Pasillas, James Cory-Wright, Víctor Sebastián-Pérez, Ailidh Burgess, Emma Cattermole, Clio Meghir, Chris Abell, Anthony G. Coyne, William R. Jacobs, Tom L. Blundell, Sangeeta Tiwari, Vitor Mendes
Computational And Structural Biotechnology Journal, 19 June 2021 DOI: 10.1016/j.csbj.2021.06.006 Journal Paper I02-Macromolecular Crystallography I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Bispecific repurposed medicines targeting the viral and immunological arms of COVID-19 Martin A. Redhead, C. David Owen, Lennart Brewitz, Amelia H. Collette, Petra Lukacik, Claire Strain-Damerell, Sean W. Robinson, Patrick M. Collins, Philipp Schäfer, Mark Swindells, Chris J. Radoux, Iva Navratilova Hopkins, Daren Fearon, Alice Douangamath, Frank Von Delft, Tika R. Malla, Laura Vangeel, Thomas Vercruysse, Jan Thibaut, Pieter Leyssen, Tu-Trinh Nguyen, Mitchell Hull, Anthony Tumber, David J. Hallett, Christopher J. Schofield, David I. Stuart, Andrew L. Hopkins, Martin A. Walsh
Scientific Reports, 11 June 2021 DOI: 10.1038/s41598-021-92416-4 Journal Paper I04-1-Macromolecular Crystallography (fixed wavelength) I24-Microfocus Macromolecular Crystallography open access A signal capture and proofreading mechanism for the KDEL-receptor explains selectivity and dynamic range in ER retrieval Andreas Gerondopoulos, Philipp Braeuer, Tomoaki Sobajima, Zhiyi Wu, Joanne L. Parker, Philip Biggin, Francis A Barr, Simon Newstead
Elife, 10 June 2021 DOI: 10.7554/eLife.68380 Journal Paper I24-Microfocus Macromolecular Crystallography open access The structural basis of fatty acid elongation by the ELOVL elongases Laiyin Nie, Tomas C. Pascoa, Ashley C. W. Pike, Simon R. Bushell, Andrew Quigley, Gian Filippo Ruda, Amy Chu, Victoria Cole, David Speedman, Tiago Moreira, Leela Shrestha, Shubhashish M. M. Mukhopadhyay, Nicola A. Burgess-Brown, James D. Love, Paul E. Brennan, Elisabeth P. Carpenter
Nature Structural & Molecular Biology, 28 June 2021 DOI: 10.1038/s41594-021-00605-6 Activation of PARP2/ARTD2 by DNA damage induces conformational changes relieving enzyme autoinhibition Ezeogo Obaji, Mirko M. Maksimainen, Albert Galera-Prat, Lari Lehtio
Nature Communications, 12 June 2021 DOI: 10.1038/s41467-021-23800-x Journal Paper I24-Microfocus Macromolecular Crystallography open access Constructing ion channels from water-soluble α-helical barrels Alistair J. Scott, Ai Niitsu, Huong T. Kratochvil, Eric J. M. Lang, Jason T. Sengel, William M. Dawson, Kozhinjampara R. Mahendran, Marco Mravic, Andrew Thomson, R. Leo Brady, Lijun Liu, Adrian J. Mulholland, Hagan Bayley, William F. Degrado, Mark I. Wallace, Derek N. Woolfson
Nature Chemistry, 537 May 2021 DOI: 10.1038/s41557-021-00688-0 Journal Paper I03-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography PGRP-LB: An inside view into the mechanism of the amidase reaction Julien Orlans, Carole Vincent-Monegat, Isabelle Rahioui, Catherine Sivignon, Agata Butryn, Laurent Soulère, Anna Zaidman-Remy, Allen M. Orville, Abdelaziz Heddi, Pierre Aller, Pedro Da Silva
International Journal Of Molecular Sciences, 22 May 2021 DOI: 10.3390/ijms22094957 Journal Paper I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Transfer of stabilising mutations between different secondary active transporter families Cristina Cecchetti, Nicola J. Scull, Thotegowdanapalya C. Mohan, Yilmaz Alguel, Alexandra M. C. Jones, Alexander D. Cameron, Bernadette Byrne
Febs Open Bio, May 2021 DOI: 10.1002/2211-5463.13168 Journal Paper I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Identification and characterization of the pyridoxal 5’-phosphate allosteric site in Escherichia coli pyridoxine 5’-phosphate oxidase Anna Barile, Theo Battista, Annarita Fiorillo, Martino Luigi Di Salvo, Francesco Malatesta, Angela Tramonti, Andrea Ilari, Roberto Contestabile
Journal Of Biological Chemistry, 4 May 2021 DOI: 10.1016/j.jbc.2021.100795 Journal Paper I24-Microfocus Macromolecular Crystallography open access Fluorinated derivatives of pyridine-2,4-dicarboxylate are potent inhibitors of human 2-oxoglutarate dependent oxygenases Lennart Brewitz, Yu Nakashima, Anthony Tumber, Eidarus Salah, Christopher J. Schofield
Journal Of Fluorine Chemistry, 30 May 2021 DOI: 10.1016/j.jfluchem.2021.109804 Journal Paper I03-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Structural basis of metallo-β-lactamase inhibition by n-sulfamoylpyrrole-2-carboxylates Alistair J. M. Farley, Yuri Ermolovich, Karina Calvopina, Patrick Rabe, Tharindi Panduwawala, Jurgen Brem, Fredrik Björkling, Christopher J. Schofield
Acs Infectious Diseases, 1277 May 2021 DOI: 10.1021/acsinfecdis.1c00104 Journal Paper I24-Microfocus Macromolecular Crystallography open access Coiled coils 9-to-5: Rational de novo design of alpha-helical barrels with tunable oligomeric states William Michael Dawson, Freddie Jo Martin, Guto G. Rhys, Kathryn L. Shelley, R. Leo Brady, Derek Woolfson
Chemical Science, Apr 2021 DOI: 10.1039/D1SC00460C Journal Paper I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Structure, immunoreactivity, and in silico epitope determination of SmSPI S. mansoni serpin for immunodiagnostic application Stefano De Benedetti, Flavio Di Pisa, Enrico Mario Alessandro Fassi, Marina Cretich, Angelo Musicò, Roberto Frigerio, Alessandro Mussida, Mauro Bombaci, Renata Grifantini, Giorgio Colombo, Martino Bolognesi, Romualdo Grande, Nadia Zanchetta, Maria Rita Gismondo, Davide Mileto, Alessandro Mancon, Louise Jane Gourlay
Vaccines, 9 Apr 2021 DOI: 10.3390/vaccines9040322 Journal Paper I24-Microfocus Macromolecular Crystallography open access Structural characterization of KKT4, an unconventional microtubule-binding kinetochore protein Patryk Ludzia, Edward D. Lowe, Gabriele Marcianò, Shabaz Mohammed, Christina Redfield, Bungo Akiyoshi
Structure, 5 Apr 2021 DOI: 10.1016/j.str.2021.04.004 Journal Paper I03-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Fungal GH25 muramidases: New family members with applications in animal nutrition and a crystal structure at 0.78Å resolution Olga V. Moroz, Elena Blagova, Edward Taylor, Johan Turkenburg, Lars K. Skov, Garry P. Gippert, Kirk M. Schnorr, Li Ming, Liu Ye, Mikkel Klausen, Marianne T. Cohn, Esben G. W. Schmidt, Søren Nymand-Grarup, Gideon J. Davies, Keith S. Wilson
Plos One, 16 Mar 2021 DOI: 10.1371/journal.pone.0248190 Journal Paper I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Structural resolution of switchable states of a de novo peptide assembly William M. Dawson, Eric J. M. Lang, Guto G. Rhys, Kathryn L. Shelley, Christopher Williams, R. Leo Brady, Matthew P. Crump, Adrian J. Mulholland, Derek N. Woolfson
Nature Communications, 12 Mar 2021 DOI: 10.1038/s41467-021-21851-8 Journal Paper I24-Microfocus Macromolecular Crystallography open access Functionalization of the BCL6 BTB domain into a noncovalent crystallization chaperone Thomas Zacharchenko, Stephanie Wright
Iucrj, 8 Mar 2021 DOI: 10.1107/S2052252520015754 Journal Paper I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Crystal structures of NUDT15 variants enabled by a potent inhibitor reveal the structural basis for thiopurine sensitivity Daniel Rehling, Si Min Zhang, Ann-Sofie Jemth, Tobias Koolmeister, Adam Throup, Olov Wallner, Emma Scaletti, Takaya Moriyama, Rina Nishii, Jonathan Davies, Matthieu Desroses, Sean G. Rudd, Martin Scobie, Evert Homan, Ulrika Warpman Berglund, Jun J. Yang, Thomas Helleday, Pal Stenmark
Journal Of Biological Chemistry, 271 Mar 2021 DOI: 10.1016/j.jbc.2021.100568 Journal Paper I24-Microfocus Macromolecular Crystallography open access Structural basis for recruitment of the CHK1 DNA damage kinase by the CLASPIN scaffold protein Matthew Day, Sarah Parry-Morris, Jack Houghton-Gisby, Antony W. Oliver, Laurence H. Pearl
Structure, 277 Mar 2021 DOI: 10.1016/j.str.2021.03.007 Journal Paper I24-Microfocus Macromolecular Crystallography open access Characterisation of a tripartite α-pore forming toxin from Serratia marcescens Alicia M. Churchill-Angus, Thomas Schofield, Thomas R. Marlow, Svetlana E. Sedelnikova, Jason S. Wilson, John B. Rafferty, Patrick J. Baker
Scientific Reports, 11 Mar 2021 DOI: 10.1038/s41598-021-85726-0 Journal Paper I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) I24-Microfocus Macromolecular Crystallography open access A small-molecule inhibitor of the BRCA2-RAD51 interaction modulates RAD51 assembly and potentiates DNA damage-induced cell death Duncan E. Scott, Nicola J. Francis-Newton, May E. Marsh, Anthony G. Coyne, Gerhard Fischer, Tommaso Moschetti, Andrew R. Bayly, Timothy D. Sharpe, Kalina T. Haas, Lorraine Barber, Chiara R. Valenzano, Rajavel Srinivasan, David J. Huggins, Miyoung Lee, Amy Emery, Bryn Hardwick, Matthias Ehebauer, Claudio Dagostin, Alessandro Esposito, Luca Pellegrini, Trevor Perrior, Grahame Mckenzie, Tom L. Blundell, Marko Hyvonen, John Skidmore, Ashok R. Venkitaraman, Chris Abell
Cell Chemical Biology, 66 Mar 2021 DOI: 10.1016/j.chembiol.2021.02.006 Journal Paper I02-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Query-guided protein–protein interaction inhibitor discovery Sergio Celis, Fruzsina Hobor, Thomas James, Gail J. Bartlett, Amaurys A. Ibarra, Deborah K. Shoemark, Zsofia Hegedus, Kristina Hetherington, Derek N. Woolfson, Richard B. Sessions, Thomas A. Edwards, David M. Andrews, Adam Nelson, Andrew J. Wilson
Chemical Science, 19 Mar 2021 DOI: 10.1039/D1SC00023C Journal Paper I03-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Structure–functional relationship of cellular retinoic acid-binding proteins I and II interacting with natural and synthetic ligands Charles W. E. Tomlinson, Katy A. S. Cornish, Andrew Whiting, Ehmke Pohl
Acta Crystallographica Section D Structural Biology, 77 Feb 2021 DOI: 10.1107/S2059798320015247 Journal Paper I03-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Fixed target serial data collection at Diamond Light Source Sam Horrell, Danny Axford, Nicholas E. Devenish, Ali Ebrahim, Michael A. Hough, Darren A. Sherrell, Selina L. S. Storm, Ivo Tews, Jonathan A. R. Worrall, Robin L. Owen
Journal Of Visualized Experiments, Feb 2021 DOI: 10.3791/62200 Journal Paper I24-Microfocus Macromolecular Crystallography open access Structural comparison of GLUT1 to GLUT3 reveal transport regulation mechanism in sugar porter family Tania Filipa Custodio, Peter Aasted Paulsen, Kelly May Frain, Bjorn Panyella Pedersen
Life Science Alliance, 4 Feb 2021 DOI: 10.26508/lsa.202000858 Journal Paper I04-1-Macromolecular Crystallography (fixed wavelength) I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access A lysine ring in HIV capsid pores coordinates IP6 to drive mature capsid assembly Nadine Renner, Donna L. Mallery, K. M. Rifat Faysal, Wang Peng, David Jacques, Till Böcking, Leo C. James
Plos Pathogens, 17 Feb 2021 DOI: 10.1371/journal.ppat.1009164 Journal Paper I24-Microfocus Macromolecular Crystallography open access Structural analysis and biochemical properties of laccase enzymes from two Pediococcus species Isidoro Olmeda, Patricia Casino, Robert E. Collins, Ramón Sendra, Sara Callejón, Juanjo Huesa, Alexei S. Soares, Sergi Ferrer, Isabel Pardo
Microbial Biotechnology, 9 Feb 2021 DOI: 10.1111/1751-7915.13751 Journal Paper I24-Microfocus Macromolecular Crystallography open access The first non‐helical Aib‐containing hexapeptide: The crystal structure of Z‐Gly‐Aib‐Gly‐Aib‐Gly‐Aib‐O t Bu Renate Gessmann, Hans Brückner, Kyriacos Petratos
Journal Of Peptide Science, 85 Feb 2021 DOI: 10.1002/psc.3307 Structural characterisation of the regulation of the catalytic subunit of the COP9 signalosome: Identification of new opportunities for drug discovery Kirsty Ford
Feb 2021 Thesis I03-Macromolecular Crystallography I04-1-Macromolecular Crystallography (fixed wavelength) I24-Microfocus Macromolecular Crystallography
Structure-based analyses of Salmonella RcsB variants unravel new features of the Rcs regulon Juanjo Huesa, Joaquín Giner-Lamia, M Graciela Pucciarelli, Francisco Paredes-Martínez, Francisco García-Del Portillo, Alberto Marina, Patricia Casino
Nucleic Acids Research, 162 Feb 2021 DOI: 10.1093/nar/gkab060 Journal Paper I03-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Fast acting allosteric phosphofructokinase inhibitors block trypanosome glycolysis and cure acute African trypanosomiasis in mice Iain W. Mcnae, James Kinkead, Divya Malik, Li-Hsuan Yen, Martin K. Walker, Chris Swain, Scott P. Webster, Nick Gray, Peter M. Fernandes, Elmarie Myburgh, Elizabeth Blackburn, Ryan Ritchie, Carol Austin, Martin A. Wear, Adrian J. Highton, Andrew J. Keats, Antonio Vong, Jacqueline Dornan, Jeremy C. Mottram, Paul A. M. Michels, Simon Pettit, Malcolm D. Walkinshaw
Nature Communications, 12 Feb 2021 DOI: 10.1038/s41467-021-21273-6 Journal Paper I03-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Molecular basis for control of antibiotic production by a bacterial hormone Shanshan Zhou, Hussain Bhukya, Nicolas Malet, Peter J. Harrison, Dean Rea, Matthew J. Belousoff, Hariprasad Venugopal, Paulina K. Sydor, Kathryn M. Styles, Lijiang Song, Max J. Cryle, Lona M. Alkhalaf, Vilmos Fulop, Gregory L. Challis, Christophe Corre
Nature, 80 Feb 2021 DOI: 10.1038/s41586-021-03195-x Journal Paper I03-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography Identification of β-strand mediated protein–protein interaction inhibitors using ligand-directed fragment ligation Zsofia Hegedus, Fruzsina Hobor, Deborah K. Shoemark, Sergio Celis, Lu-Yun Lian, Chi H. Trinh, Richard B. Sessions, Thomas A. Edwards, Andrew J. Wilson
Chemical Science, 153 Jan 2021 DOI: 10.1039/D0SC05694D Journal Paper I03-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access A non‐helical region in transmembrane helix 6 of hydrophobic amino acid transporter MhsT mediates substrate recognition Dorota Focht, Caroline Neumann, Joseph Lyons, Ander Eguskiza Bilbao, Rickard Blunck, Lina Malinauskaite, Ilona O Schwarz, Jonathan A Javitch, Matthias Quick, Poul Nissen
The Embo Journal, 40 Jan 2021 DOI: 10.15252/embj.2020105164 Journal Paper I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography Structures of the archaerhodopsin-3 transporter reveal that disordering of internal water networks underpins receptor sensitization Juan F. Bada Juarez, Peter J. Judge, Suliman Adam, Danny Axford, Javier Vinals, James Birch, Tristan O. C. Kwan, Kin Kuan Hoi, Hsin-Yung Yen, Anthony Vial, Pierre-Emmanuel Milhiet, Carol V. Robinson, Igor Schapiro, Isabel Moraes, Anthony Watts
Nature Communications, 12 Jan 2021 DOI: 10.1038/s41467-020-20596-0 Journal Paper B23-Circular Dichroism I24-Microfocus Macromolecular Crystallography open access Structure of the complete dimeric human GDAP1 core domain provides insights into ligand binding and clustering of disease mutations Giang Thi Tuyet Nguyen, Aleksi Sutinen, Arne Raasakka, Gopinath Muruganandam, Remy Loris, Petri Kursula
Frontiers In Molecular Biosciences, 7 Jan 2021 DOI: 10.3389/fmolb.2020.631232 Journal Paper B21-High Throughput SAXS I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Megabodies expand the nanobody toolkit for protein structure determination by single-particle cryo-EM Tomasz Uchański, Simonas Masiulis, Baptiste Fischer, Valentina Kalichuk, Uriel López-Sánchez, Eleftherios Zarkadas, Miriam Weckener, Andrija Sente, Philip Ward, Alexandre Wohlkonig, Thomas Zogg, Han Remaut, James Naismith, Hugues Nury, Wim Vranken, A. Radu Aricescu, Els Pardon, Jan Steyaert
Nature Methods, 18 Jan 2021 DOI: 10.1038/s41592-020-01001-6 Journal Paper B21-High Throughput SAXS I03-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography Structural basis of malaria parasite phenylalanine tRNA-synthetase inhibition by bicyclic azetidines Manmohan Sharma, Nipun Malhotra, Manickam Yogavel, Karl Harlos, Bruno Melillo, Eamon Comer, Arthur Gonse, Suhel Parvez, Branko Mitasev, Francis G. Fang, Stuart L. Schreiber, Amit Sharma
Nature Communications, 12 Jan 2021 DOI: 10.1038/s41467-020-20478-5 Journal Paper I24-Microfocus Macromolecular Crystallography open access A functional family of fluorescent nucleotide analogues to investigate actin dynamics and energetics Jessica Colombo, Adrien Antkowiak, Konstantin Kogan, Tommi Kotila, Jenna Elliott, Audrey Guillotin, Pekka Lappalainen, Alphée Michelot
Nature Communications, 12 Jan 2021 DOI: 10.1038/s41467-020-20827-4 Journal Paper I24-Microfocus Macromolecular Crystallography open access Structural characterisation of a novel GPVI nanobody-complex reveals a biologically active domain-swapped GPVI dimer Alexandre Slater, Ying Di, Joanne C Clark, Natalie Jasmin Jooss, Eleyna M Martin, Fawaz Obaidullah Alenazy, Mark R. Thomas, Robert A. S. Ariëns, Andrew B. Herr, Natalie S. Poulter, Jonas Emsley, Stephen P. Watson
Blood, Jan 2021 DOI: 10.1182/blood.2020009440 Journal Paper I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography A tamoxifen receptor within a voltage-gated sodium channel Altin Sula, David Hollingworth, Leo C. T. Ng, Megan Larmore, Paul G. Decaen, Bonnie A. Wallace
Molecular Cell, 350 Jan 2021 DOI: 10.1016/j.molcel.2020.12.048 Journal Paper I03-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography open access Mutations in SKI in Shprintzen–Goldberg syndrome lead to attenuated TGF-β responses through SKI stabilization Ilaria Gori, Roger George, Andrew G. Purkiss, Stephanie Strohbuecker, Rebecca A Randall, Roksana Ogrodowicz, Virginie Carmignac, Laurence Faivre, Dhira Joshi, Svend Kjær, Caroline S Hill
Elife, 10 Jan 2021 DOI: 10.7554/eLife.63545 Journal Paper I24-Microfocus Macromolecular Crystallography open access Structural characterisation of a carbohydrate binding domain of the human cation-independent mannose 6-phosphate/ IGF2 receptor Alice J. Bochel
Jan 2021 Thesis B21-High Throughput SAXS I03-Macromolecular Crystallography I04-Macromolecular Crystallography I24-Microfocus Macromolecular Crystallography
High-resolution crystal structure of human pERp1, a saposin-like protein involved in IgA, IgM and integrin maturation in the endoplasmic reticulum Sven T. Sowa, Antti Moilanen, Ekaterina Biterova, Mirva J. Saaranen, Lari Lehtio, Lloyd W. Ruddock
Journal Of Molecular Biology, Jan 2021 DOI: 10.1016/j.jmb.2021.166826 Journal Paper I24-Microfocus Macromolecular Crystallography open access