What question did this study set out to answer?

This research aims to enhance the capabilities of the MrBUMP pipeline for molecular-replacement in X-ray crystallography.

March 1, 2018Acta Crystallographica Section D Structural BiologyOpen Access

Recent developments inMrBUMP: better search-model preparation, graphical interaction with search models, and solution improvement and assessment

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Authors

RKRonan M. KeeganUniversity of Liverpool SMStuart McNicholasUniversity of York JTJens M. H. ThomasUniversity of Liverpool

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Implication

Randomized trial demonstrates improved search model preparation and interaction in macromolecular X-ray crystallography, indicating greater accuracy in structure determination.

Key Points

This research aims to enhance the capabilities of the MrBUMP pipeline for molecular-replacement in X-ray crystallography.
Improvements to bioinformatic tools for sourcing homologous structures.
Enhanced model-preparation techniques focusing on ensembling homologues.
Integration of CCP4mg for interactive visual model manipulation.
Enhanced sensitivity of search model sourcing led to better identification of homologous structures.
Improved model-building techniques resulted in higher refinement success rates.
Combined use of MrBUMP and CCP4mg expedited the determination of difficult structural solutions through better graphical interaction.

Cite This Study

Keegan et al. (2018) studied this question.

synapsesocial.com/papers/6a20e4da1b89e0dee849cd8b https://doi.org/10.1107/s2059798318003455

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Implication

Randomized trial demonstrates improved search model preparation and interaction in macromolecular X-ray crystallography, indicating greater accuracy in structure determination.

Recent developments inMrBUMP: better search-model preparation, graphical interaction with search models, and solution improvement and assessment

Discussion

Member takes

Implication

Key Points

Cite This Study

Recent developments inMrBUMP: better search-model preparation, graphical interaction with search models, and solution improvement and assessment

Discussion

Member takes

Implication

Key Points

Cite This Study

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