pims overview: version 0.3 & beyond
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PiMS overview: version 0.3 & beyond. Robert Esnouf, PiMS Project Sponsor, Oxford. PiMS mission statement…. “To produce a commercial-quality freely available laboratory information management system (LIMS) suitable for use in structural biology laboratories” - PowerPoint PPT PresentationTRANSCRIPT
PiMS overview: version 0.3 & beyond
Robert Esnouf, PiMS Project Sponsor, Oxford
PiMS mission statement… “To produce a commercial-quality freely available
laboratory information management system (LIMS) suitable for use in structural biology laboratories”
Many (partially) failed efforts in the past Process is very complex (by previous LIMS standards) Research processes rapidly evolve (need configuration
rather than customization) No two laboratories have the same working practices
The story of PiMS so far… PiMS is a loose consortium involving labs in UK, France
and elsewhere PiMS is also the name of a BBSRC SPoRT grant in the
UK and is heavily supported by CCP4 PiMS SPoRT grant required reapplication supported by
other SPoRT award holders (SSPF and MPSI) PiMS effectively started Apr 2005, Bill Lin Feb 2006 Management structure re-investigated late 2005 Created part-time ‘Project Sponsor’ role late Jan 2006 Version 0.3 released ~25 February 2006 Developer meeting to start new structure 17 March
PiMS (and associated) staff Supported directly by PiMS grant
Ed Daniel (Daresbury), Anne Pajon (EBI), Katya Pilicheva (OPPF), Susy Griffiths (York – not full time)
Supported by CCP4 Chris Morris (Daresbury – project manager), Bill Lin
(Daresbury) Supported by BBSRC at SSPF, MPSI and OPPF
Jo van Niekerk (Dundee), Petr Troshin (Daresbury), Jon Diprose (OPPF)
Not available full-time to PiMS Supported by MRC
Robert Esnouf (OPPF – part time)
Diagram of new PiMS structure
Robert E
Developer DeveloperDeveloperDeveloperDeveloper
Chris M
Line Man. Line Man.
Project SteeringBoard
Strategy andpriorities
Progress andissues
Major featurerequests
Major featurerequests
Local issues andrequirements;daily management
Tasks, coordinationprogress monitoring
Components of PiMS (1) Standardized, consistent user interface Multiple views onto database
Detailed view of experiments (processes) Tracking of ‘target’ / ‘construct’ progress Simplified view of project / laboratory progress Views based on samples / users / locations / activities
Administration (configuration and management roles) Security / authorization module / access control / roles Interface for multiple databases and web services Locations / people / groups / projects Sample and reagent description / tracking Integration of robotic platforms
run sequence files output files
Components of PiMS (2) Potential target collection / annotation Target selection and construct design Project progress / target tracking Non-plate experiments
Expression, purification, custom experiments Plate experiments
PCR, cloning, crystallization QA experiments
Gels, mass spectroscopy, sequencing, DLS Reporting / virtual lab book Crystallization setup and imaging (eHTPX and BioXHIT) Links to x-ray data collection (eHTPX) Reagent management … more sophisticated features …
Where is PiMS currently? PiMS version 0.3 ‘released’ 25 February 2006
Logging on Target tracking Reagent management A basic, but generic, user interface (Ability to record experimental information) (Definition of work required for crystallization) MPSI target data from Leeds have been entered
PiMS releases 2006 PiMS version 0.4, 24 May 2006
Provide DB support for SPoT Beginnings of consistent user interface / better web site Target progress / tracking
PiMS version 0.5, 2 October 2006 Major upgrade of database machinery Consistent user interface throughout Experiments and protocols
PiMS version 1.0, 4 December 2006 Plate experiments Crystallization interface (work with BioXHIT) … Crystal shipping (draw on eHTPX) …
PiMS crystallization module Module to cover management
of crystallization trials Shared development with
BioXHIT allowing externalresources to contribute toPiMS goals
A self contained and well understood module
One of most demanding interms of database use anduser interface performance
Of immediate use to several PiMS sites
Four-way grouping: OPPF, NKI, EMBL Grenoble, Paris-Sud
PiMS primarily intended to cover protein production Molecular biology, protein expression, purification
This is only part of the whole process Target annotation precedes production Crystallization follows production (for most PiMS sites) Both parts should eventually be integrated into PiMS to
give extended framework Structure solution / refinement / deposition
eHTPX hub/portal covers getting crystals to beam lines Cryo-treatment of crystals Links back to crystallization data Links forward to x-ray experiment data Beam line logs
PiMS and eHTPX hub/portal