PAIREF : paired refinement also for Phenix users

Kurzanzeige
dc.contributor.authorMalý, Martin
dc.contributor.authorDiederichs, Kay
dc.contributor.authorDohnálek, Jan
dc.contributor.authorKolenko, Petr
dc.date.accessioned2021-07-05T07:04:38Z
dc.date.available2021-07-05T07:04:38Z
dc.date.issued2021-07-01eng
dc.description.abstractIn macromolecular crystallography, paired refinement is generally accepted to be the optimal approach for the determination of the high-resolution cutoff. The software tool PAIREF provides automation of the protocol and associated analysis. Support for phenix.refine as a refinement engine has recently been implemented in the program. This feature is presented here using previously published data for thermolysin. The results demonstrate the importance of the complete cross-validation procedure to obtain a thorough and unbiased insight into the quality of high-resolution data.eng
dc.description.versionpublishedeng
dc.identifier.doi10.1107/S2053230X21006129eng
dc.identifier.pmid34196613eng
dc.identifier.ppn1762785412
dc.identifier.urihttps://kops.uni-konstanz.de/handle/123456789/54180
dc.language.isoengeng
dc.rightsterms-of-use
dc.rights.urihttps://rightsstatements.org/page/InC/1.0/
dc.subjectmacromolecular crystallography; PAIREF; Phenix; X-ray diffraction; paired refinement; high-resolution limiteng
dc.subject.ddc570eng
dc.titlePAIREF : paired refinement also for Phenix userseng
dc.typeJOURNAL_ARTICLEeng
dspace.entity.typePublication
kops.citation.bibtex
@article{Maly2021-07-01PAIRE-54180,
  year={2021},
  doi={10.1107/S2053230X21006129},
  title={PAIREF : paired refinement also for Phenix users},
  number={7},
  volume={77},
  issn={1744-3091},
  journal={Acta crystallographica, Section F : Structural biology communications},
  pages={226--229},
  author={Malý, Martin and Diederichs, Kay and Dohnálek, Jan and Kolenko, Petr}
}
kops.citation.iso690MALÝ, Martin, Kay DIEDERICHS, Jan DOHNÁLEK, Petr KOLENKO, 2021. PAIREF : paired refinement also for Phenix users. In: Acta crystallographica, Section F : Structural biology communications. International Union of Crystallography (IUCr). 2021, 77(7), pp. 226-229. ISSN 1744-3091. eISSN 2053-230X. Available under: doi: 10.1107/S2053230X21006129deu
kops.citation.iso690MALÝ, Martin, Kay DIEDERICHS, Jan DOHNÁLEK, Petr KOLENKO, 2021. PAIREF : paired refinement also for Phenix users. In: Acta crystallographica, Section F : Structural biology communications. International Union of Crystallography (IUCr). 2021, 77(7), pp. 226-229. ISSN 1744-3091. eISSN 2053-230X. Available under: doi: 10.1107/S2053230X21006129eng
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source.periodicalTitleActa crystallographica, Section F : Structural biology communicationseng
source.publisherInternational Union of Crystallography (IUCr)eng

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