Please note - all session times are displayed in Central European Time (CET)
Monday - 8th November 2021
| 13:30-13:45 | Webinar Opens Djordje Musil, Jose Marquez, Romain Talon |
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| Workshop1 CryoEM (facilities, sample preparation, data collection and processing) Co-chairs: Chiara Rapisarda, Maryam Khoshouei |
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| 13:45-14:00 | Marta Carroni, SciLifeLab, Sweden: "Facilitating accessibility to cryo-EM – The Swedish cryo-EM facility" | ||
| 14:00-14:15 | Andreas Schenck, Novartis, Switzerland: "Streamlining data collection and analysis for cryo-EM based structure determination" | ||
| 14:15-14:30 | Mathieu Botte, leadXpro, Switzerland: "Sample Preparation for Cryo-EM: Challenges and Perspectives" | ||
| 14:30-14:45 | Michael Saur, Astex, UK: “Fragment-based drug discovery using cryo-EM – a future perspective” | ||
| 14:45-15:15 | Workshop 1 Discussion Forum | ||
| 15:15-15:30 | Break (including poster sessions) |
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| 15:15-15:18 | Poster Session A Arkita Bandyopadhyay, P01: Structural and functional characterization of ATPase domain of Rv3870 of M. tuberculosis ESX-1 system |
Poster Session B Melissa Ann Graewert, P12: Structural Characterization of biopharmaceuticals with solution small angle scattering |
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| 15:18-15:21 | Diana O. Silva, P04: Targeting human Cyclophilin D as a Drug Target - Towards the discovery of new CypD inhibitors | Alexey Vlasov, P09: ATP synthases are targets for new drugs |
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| 15:21-15:30 | Poster Session Q&A Arkita Bandyopadhyay & Diana O. Silva |
Poster Session Q&A Melissa Ann Graewert & Alexey Vlasov |
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| Moderators: Djordje Musil & Romain Talon | Moderator: Josan Marquez |
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| Session 1: AI opportunities in SBDD Co-Chairs: Chun-wa Chung, Sandra Cowan-Jacob, Daniel Kuhn |
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| 15:30-16:00 | Lewis Mervin AZ, UK and Ola Engkvist, AZ, Sweden: "Privacy preserving machine learning in the pharmaceutical industry" | ||
| 16:00-16:30 | Ilaria Ferlenghi, GSK, UK: “GEMINI: an integrated structure and AI based approach for new vaccine identification” | ||
| 16:30-17:00 | Lovisa Holmberg Schiavone and Aurelie Bornot, AZ, Sweden: "A pre-competitive consortium to share data and build predictive models for recombinant protein expression" | ||
| 17:00-17:30 | Session 1 Discussion Forum | ||
| 17:30-18:30 | Keynote Lecture Andrew R. Leach, EBI/EMBL UK: "Will accurate computational prediction of protein structure change drug discovery?" Co-Chairs: Chun-wa Chung |
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| 18:30-19:30 | Networking | ||
Tuesday - 9th November 2021
| 13:30-13:35 | Webinar Opens | ||
| Workshop 2 Automation and Method Development in Crystallography Co-chairs: Romain Talon, Edward Mitchell |
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| 13:35-13:50 | iNext presentation Anastassis Perrakis |
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| 13:50-14:05 | Saravanan Panneerselvam, EMBL, Germany: "Macromolecular Crystallography at EMBL Hamburg" | ||
| 14:05-14:20 | Jose Antonio Marquez, ALPX, ALPX, France: "Automated crystallography pipelines for small-molecule screening and membrane proteins" | ||
| 14:20-14:35 | Matthew W. Bowler, EMBL, France: "How MXPress workflows use automated decision-making to get the best possible data from your samples" | ||
| 14:35-14:50 | Lisa J. Keefe, IMCA-CAT, US: “Design with Purpose at IMCA-CAT: Focusing on Industry Needs” | ||
| 14:50-15:05 | Joachim Diez, Expose, Switzerland: "„Never waste a good crisis“- how the rise of Cryo-EM and the cumulative synchrotron dark times can lead to quality of life improvements for industrial MX-users" | ||
| 15:05-15:20 | Discussion | ||
| 15:20-15:25 | IBM Aspera/SVA Sponsor Talk | ||
| 15:25-15:30 | Thermo Fisher: Epitope mapping of SARS-CoV-2 spike-fab complexes using cryo-EM | ||
| 15:30-15:35 | Beckman Coulter: Introduction into Analytical Ultracentrifugation, AUC – enabling for protein characterization in solution | ||
| 15:35-15:50 | Break (including poster sessions) | ||
| 15:30-15:33 | Poster Session C Tobias Krojer, P11: FragMAx Crystallographic fragment screening at MAX IV |
Poster Session D Amy Danson, P05: Super-Resolution fluorescence microscopy reveals clustering behaviour of Chlamydia pneumoniae's Major Outer Membrane Protein |
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| 15:33-15:36 | Tristan O. C. Kwan, P02: High throughput approach to prepare high-density microcrystals in lipidic cubic phase for serial crystallography and fragment screening | Holger von Moeller and Sophie Zimmermann P08: Automation and method development in crystallography – Every Crystal Matters | |
| 15:36-15:50 | Poster Session Q&A Tobias Krojer & Tristan O. C. Kwan |
Poster Session Q&A Amy Danson, Holger von Moeller and Sophie Zimmermann |
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| Moderators: Josan Marquez & Romain Talon | Moderator: Djordje Musil | ||
| ⠀⠀⠀⠀ | Session 2: Integrative Structural Biology Co-chairs: Taiana Maia De Oliveira, Alexey Rak |
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| 15:50-16:10 | John Briggs, MRC, UK: „In virus structural biology of SARS-CoV-2 and other viruses“ | ||
| 16:10-16:30 | Taiana Maia De Oliveira, AZ, UK: „Cryo-EM and Integrative Structural Biology at AstraZeneca“ | ||
| 16:30-16:50 | Dmitri Svergun, EMBL-Hamburg, Germany: “Integrative studies with solution X-ray scattering” | ||
| 16:50-17:10 | Juri Rappsilber, TU-Berlin, Germany: “In-cell integrative structural biology of transcription-translation coupling” | ||
| 17:10-17:20 | Session 2 Question Session | ||
| 17:20-17:30 | Break and Networking | ||
| 17:30-18:15 | Virtual EPN (ESRF, EMBL, IBS, ILL) Facility Tour The European Photon & Neutron (EPN) Science Campus host four major institutes - ESRF, EMBL, ILL and IBS - which all together founded the Partnership for Structural Biology (PSB).The EPN campus offers a unique combination of facilities for structural Biology including access to X-ray, Cryo-EM, Neutrons, NMR and sample preparation services in a single site. In this virtual tour EPN scientists will take you around the campus visiting some of our facilities. Moderators: Romain Talon & Josan Marquez |
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| 18:15-19:15 | Networking | ||
Wednesday - 10th November 2021
| 13:45-13:50 | Webinar Opens | |
| Session 3: Scientific data management in the era of big data Co-Chairs: Markus Kroemer, Jose Marquez, Djordje Musil |
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| 13:50-14:00 | Introduction – Markus Kroemer, Novartis, Switzerland | |
| 14:00-14:20 | Raphael Bourgeas, EMBL, France and Clemens Vonrhein, Global Phasing Ltd, UK: “Integrated management analysis and interpretation of data along the crystallography experimental workflow” | |
| 14:20-14:40 | Robbie Joosten, NKI, The Netherlands: „Speeding up the last mile of structure solution with PDB-REDO“ | |
| 14:40-15:00 | Mihaly Varadi, EBI, UK: “PDBe-KB: An integrated knowledge base of molecular structures and their functional annotations that supports large scale data mining” | |
| 15:00-15:30 | Session 3 Discussion Forum | |
| 15:30-15:35 | Rigaku Sponsor Talk | |
| 15:35-15:40 | Dynamic Biosensors: heliX® – the new-generation modular biosensor for molecular interactions | |
| 15:40-15:45 | Xenocs Sponsor Talk | |
| 15:45-16:00 | Break and Networking | |
| Session 4: Case studies Co-chairs: Alexey Rak, Paul Rowland |
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| 16:00-16:20 | Jan Steyaert, Vrije Universiteit Brussel, Belgium: „From Nanobodies to Megabodies for applications in cryo-EM“ | |
| 16:20-16:40 | Frank von Delft, University of Oxford, UK: "Systematic progression of fragments by linking AI and experiment by robotics" | |
| 16:40-17:00 | Rob van Montfort, ICR, UK: “Achieving in vivo target depletion through the discovery and optimization of benzimidazolone BCL6 degraders” | |
| 17:00-17:20 | Markus G. Rudolph, Roche, Switzerland: “Selective DDR1 over DDR2 inhibitors from efficient screening and structure-guided design” | |
| 17:20-17:30 | Session 4 Question Session | |
| 17:30-17:35 | Closing remarks Djordje Musil, Romain Talon, Josan Marquez |
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| 17:35-18:35 | Networking |