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Of problems and opp...
Of problems and opportunities—How to treat and how to not treat crystallographic fragment screening data
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- Weiss, Manfred S. (författare)
- Helmholtz Association of German Research Centers
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- Wollenhaupt, Jan (författare)
- Helmholtz Association of German Research Centers
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- Correy, Galen J. (författare)
- University of California, San Francisco
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- Fraser, James S. (författare)
- University of California, San Francisco
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- Heine, Andreas (författare)
- Philipp University of Marburg
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- Klebe, Gerhard (författare)
- Philipp University of Marburg
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- Krojer, Tobias (författare)
- Lund University,Lunds universitet,MAX IV-laboratoriet,MAX IV Laboratory
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- Thunissen, Marjolein (författare)
- Lund University
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- Pearce, Nicholas M. (författare)
- Vrije Universiteit Amsterdam
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(creator_code:org_t)
- 2022-08-29
- 2022
- Engelska.
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Ingår i: Protein Science. - : Wiley. - 0961-8368 .- 1469-896X. ; 31:9
- Relaterad länk:
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http://dx.doi.org/10... (free)
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https://lup.lub.lu.s...
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https://doi.org/10.1...
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Abstract
Ämnesord
Stäng
- In their recent commentary in Protein Science, Jaskolski et al. analyzed three randomly picked diffraction data sets from fragment-screening group depositions from the PDB and, based on that, they claimed that such data are principally problematic. We demonstrate here that if such data are treated properly, none of the proclaimed criticisms persist.
Ämnesord
- NATURVETENSKAP -- Biologi (hsv//swe)
- NATURAL SCIENCES -- Biological Sciences (hsv//eng)
Nyckelord
- compositional heterogeneity
- conformational heterogeneity
- fragment-screening
- group depositions
- low-occupancy ligands
- PanDDA
Publikations- och innehållstyp
- art (ämneskategori)
- ref (ämneskategori)
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