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Workflow and Tools for Crystallographic Fragment Screening at the Helmholtz-Zentrum Berlin
This content is Free Access.
1Macromolecular Crystallography,Helmholtz-Zentrum Berlin, 2Structural Biochemistry Group, Institute for Chemistry and Biochemistry,Freie Universität Berlin, 3BioMAX,MAX IV Laboratory, 4Drug Design Group, Institute of Pharmaceutical Chemistry,Philipps-Universität Marburg, 5Department Sample Environment,Helmholtz-Zentrum Berlin
Chapters
- 00:04Introduction
- 01:01Soaking Crystals
- 03:14Harvesting Crystals
- 04:46Results: Photographic Snapshots of Some Crystalline Samples and Crystallographic Fragment Screening
- 05:55Conclusion
Crystallographic fragment screening at the Helmholtz-Zentrum Berlin is performed using a workflow with dedicated compound libraries, crystal handling tools, fast data collection facilities and largely automated data analysis. The presented protocol intends to maximize the output of such experiments to provide promising starting points for downstream structure-based ligand design.
