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Updated: Jun 10, 2026

Investigating Protein Sequence-structure-dynamics Relationships with Bio3D-web
Published on: July 16, 2017
Capturing, sharing and analysing biophysical data from protein engineering and protein characterization studies.
Damien Farrell1, Fergal O'Meara, Michael Johnston
1Centre for Synthesis and Chemical Biology, School of Biomolecular and Biomedical Science, UCD Conway Institute, University College Dublin, Belfield, Dublin 4, Ireland.
A new tool, PEAT (Protein Engineering Analysis Tool), aids researchers in managing protein engineering data. It integrates data deposition, analysis, and sharing, addressing the loss of experimental data and supporting theoretical advancements.
Area of Science:
- Biochemistry
- Molecular Biology
- Bioinformatics
Background:
- Vast amounts of protein sequence, structure, and function data are generated annually.
- Much experimental data is lost in publications, hindering theoretical research and algorithm development.
- Theoretical scientists require experimental data for validating predictive algorithms.
Purpose of the Study:
- To present PEAT (Protein Engineering Analysis Tool), an integrated application for protein engineering research.
- To facilitate data deposition, storage, and analysis for researchers.
- To address the challenge of lost experimental data and support theoretical progress.
Main Methods:
- Development of the Protein Engineering Analysis Tool (PEAT).
- Integration of modules for DNA sequence manipulation and primer design.
- Inclusion of modules for fitting biophysical characterization data (enzyme kinetics, spectroscopy, NMR titration).
Main Results:
- PEAT provides a centralized platform for managing protein engineering data.
- The tool facilitates the sharing of experimental data and analyses within research groups.
- PEAT supports researchers in biophysical characterization and protein design.
Conclusions:
- PEAT addresses the critical need for accessible and organized experimental protein data.
- The application enhances the efficiency of protein engineering research and theoretical validation.
- PEAT is freely available to academic researchers, promoting data sharing and scientific advancement.
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