Course at EMBL-EBI
Structural bioinformatics
Structural biology, determining the three-dimensional shapes of biomacromolecules and their complexes, can tell us a lot about how these molecules function and the roles they play within a cell. Bioinformatics data derived from structure determination experiments enables life-science researchers to address a wide variety of questions. For example, it aids the understanding of how mutations in a gene might alter a protein’s shape, disrupt a catalytic site, or alter the binding affinity of a pharmaceutical compound.
This course explores bioinformatics data resources and tools for the interpretation and exploitation of biomacromolecular structures. It will focus on how best to analyse available structural data to gain useful information given specific research contexts. The course content will investigate the impact of genetic variation on structure, predicting protein structure and function, and exploring interactions with other macromolecules as well as with low-MW compounds. Participants will also have an opportunity to explore protein docking using HADDOCK.
Who is this course for?
This course is for biological researchers who want to learn more about the application of structural information in their work and how to use some of the key bioinformatics resources that are available. No previous experience in the field of structural bioinformatics is required, however a basic knowledge of protein structure would be of benefit. Participants should be familiar with basic Linux operations - http://www.ee.surrey.ac.uk/Teaching/Unix/ - and have some experience of bioinformatics tools and databases.
What will I learn?
Learning outcomes
At the end of this course, trainees will be able to:
- Access and browse a range of structural data repositories
- Determine whether appropriate structural information exists about a given molecule or complex, applying available structure-quality information
- Build a structural model for a protein which has a structurally characterised relative and evaluate its quality
- Evaluate the potential impact of genetic variation on a structure
- Predict the function of a protein based on sequence and structure data
- Explore protein complex modelling approaches
Trainers
Ajay Mishra
EMBL-EBI, UK Gerard Kleywegt
EMBL-EBI, UK Christine Orengo
University College London, UK David Armstrong
EMBL-EBI, UK Deepti Gupta
EMBL-EBI, UK Rob Finn
EMBL-EBI, UK Lorna Richardson
EMBL-EBI, UK Franca Fraternali
Kings College London, UK Osman Salih
EMBL-EBI, UK Alexandre Bonvin
Utrecht University, Netherlands Lawrence Kelley
Imperial College London Anna Gaulton
EMBL-EBI, UK Andrew Martin
University College London, UK James Stephenson
EMBL-EBI, UK Madan Babu
MRC Laboratory of Molecular Biology Rodrigo Vargas Honorato
Utrecht University, Netherlands Ian Sillitoe
University College London Sjors Scheres
MRC Laboratory of Molecular Biology, Cambridge, UK
EMBL-EBI, UK
EMBL-EBI, UK
University College London, UK
EMBL-EBI, UK
EMBL-EBI, UK
EMBL-EBI, UK
EMBL-EBI, UK
Kings College London, UK
EMBL-EBI, UK
Utrecht University, Netherlands
Imperial College London
EMBL-EBI, UK
University College London, UK
EMBL-EBI, UK
MRC Laboratory of Molecular Biology
Utrecht University, Netherlands
University College London
MRC Laboratory of Molecular Biology, Cambridge, UK
Programme
Day 1 – Monday 16th September 2019 |
||
|---|---|---|
| 12:00 – 13:00 | Arrival, registration and lunch | |
| 13:00 – 14:00 | Welcome and introductions | Ajay Mishra |
| 14:00 – 14:30 | Introduction to structural biology data | Gerard Kleywegt |
| 14:30 – 15:30 | Introduction to PDBe resources & group activity | David Armstrong / PDBe Team |
| 15:30 – 16:00 | Break | |
| 16:00 – 17:30 | Finding and validating structural data | Deepti Gupta / PDBe Team |
| 17:30 – 19:00 | Poster session & drinks reception | |
| 19:30 | Dinner at Hinxton Hall |
Day 2 – Tuesday 17th September 2019 |
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|---|---|---|
| 9:00 – 10:30 | Fast, sensitive homology detection using HMMER | Rob Finn |
| 10:30 – 11:00 | Break | |
| 11:00 – 12:30 | Sequence and structure based signatures | Lorna Richardson |
| 12:30 – 13:30 | Lunch & posters | |
| 13:30 – 15:00 | Protein folds and structural family resources | Ian Sillitoe |
| 15:00 – 15:30 | Break | |
| 15:30 – 17:30 | Protein structure prediction | Lawrence Kelley |
| 17:30 – 18:30 | Keynote: Data driven approaches to biological systems | Madan Babu |
| 18:30 | End of day | |
| 19:30 | Dinner at Hinxton Hall |
Day 3 – Wednesday 18th September 2019 |
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|---|---|---|
| 9:00 – 11:00 | Exploring protein docking with HADDOCK (lecture) | Alexandre Bonvin |
| 11:00 – 11:30 | Break | |
| 11:30 – 12:30 | Exploring protein docking with HADDOCK (practical) | Alexandre Bonvin / Rodrigo Vargas-Honorato |
| 12:30 – 13:30 | Lunch & posters | |
| 13:30 – 14:30 | Exploring protein docking with HADDOCK (practical cont.) | Alexandre Bonvin / Rodrigo Vargas-Honorato |
| 14:30 – 15:30 | PDBe tools - how to analyse a structure | David Armstrong / PDBe Team |
| 15:30 – 16:00 | Break | |
| 16:00 – 18:00 | PDBe-KB aggregated views of protein structure data | David Armstrong / PDBe Team |
| 18:00 | End of day | |
| 19:00 | Dinner at Hinxton Hall |
Day 4 – Thursday 19th September 2019 |
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|---|---|---|
| 9:00 – 11:00 | Variant / mutation mapping | James Stephenson |
| 11:00 – 11:30 | Break | |
| 11:30 – 13:00 | SAAPdb and other resources exploiting structure to determine the impacts of mutations | Andrew Martin |
| 13:00 – 14:00 | Lunch & posters | |
| 14:00 – 16:00 | Resources for protein interactions and complexes | Franca Fraternali |
| 16:00 – 16:30 | Break | |
| 16:30 – 18:30 | EM data and protein complexes | Osman Salih |
| 18:30 | End of day | |
| 19:30 | Dinner at Red Lion, Hinxton |
Day 5 – Friday 20th September 2019 |
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|---|---|---|
| 9:00 – 10:30 | Drug discovery and ChEMBL | Anna Gaulton and ChEMBL Team |
| 10:30 – 11:00 | Break | |
| 11:00 – 12:00 | Keynote: The Cryo-EM resolution revolution | Sjors Scheres |
| 12:00 – 13:00 | Course discussion, wrap-up and feedback | |
| 13:00 – 13:45 | Lunch | |
| 13:45 | Shuttle to Cambridge Station (Stop 5) |
Please read our page on application advice before starting your application. In order to be considered for a place on this course, you must do the following:
- Complete the online application form.
- Provide a Microsoft Word (.docx) document containing three short paragraphs with a biography, work history and description of your current research interests; each paragraph should be no more than 100 words.
- Provide a letter of support from a supervisor or a senior co-worker explaining why you should be selected for this course.
Please submit all documents to Marina Pujol (mpujol@ebi.ac.uk) by 12:00 GMT on Friday 14 June, 2019.
Incomplete applications will not be considered.
All participants are expected to present a poster that will be displayed during the course outside the training room. Please send your poster in PDF format to Marina Pujol (mpujol@ebi.ac.uk) and we will print it on campus.
All posters should:
• be A2 in size - 420mm x 594 mm
• be in a portrait orientation
• include your photograph and contact information
We expect the posters to act as a talking point between you, other participants and the trainers on the course. The posters will be displayed throughout the week so people can view them during breaks and lunch. They should give the reader an idea of the work you are engaged in, what you are planning to do next, and anything of interest that might be useful for sharing with the gathered participants.
Accommodation will be provided onsite at the Wellcome Genome Campus Conference Centre. Please contact them directly if you wish to arrange to stay additional nights around the course dates.
The course includes evening meals at the Hinxton Hall Restaurant on campus or the Red Lion Pub in nearby Hinxton village, and breaks and lunches outside the EMBL-EBI training rooms.