Computational methods development in X-ray crystallography: improved analysis 
of potential medicines bound to protein crystals

GlaxoSmithKline (GSK) is a research-based pharmaceutical company with a share 
of around 5% of the world's pharmaceutical market and around 13,000 people 
actively working in research teams to discover new medicines.

This position is a 6-8 week contract aimed at an enthusiastic individual to 
work within the Structural Biology team at the R&D site in Stevenage (summer 
2013).

New advances in X-ray technologies allow rapid data collection from protein 
crystals, providing an opportunity to systematically screen many different 
chemical compounds (ligands) against a protein of interest. In GSK we have 
developed software wrappers for routines to automatically process X-ray 
diffraction data and present electron density maps with proposed ligand poses 
that the scientist can access and manage through a web based interface. We are 
now looking to enhance the capabilities of this platform through a more 
in-depth analysis of current ligand binding computational protocols.

This project will involve programming in Python, Javascript and HTML to 
compliment crystallographic software developed from the CCP4, Phenix and Global 
Phasing software developments.

Salary levels are available on request.


Please send your CV to the email address below:
Contact: [email protected]

Closing date: April 30th 2013



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