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Figure 1
PMRDD test applied to a xylose isomerase serial dataset collected at T-REXX. Each panel shows a PyMOL (v.2.5.0; Schrödinger) generated equivalent of a Coot (Emsley et al., 2010View full citation) screenshot, showing 2mFoDFc electron-density maps contoured at 1.5 r.m.s.d. (blue mesh) and mFoDFc electron-density maps contoured at ±3.0 r.m.s.d. (green, +3.0 r.m.s.d.; red, −3.0 r.m.s.d. mesh). In each panel, the `true' starting model is shown as sticks with carbons coloured orange. The edited `PMRDD model' is shown as sticks with carbons coloured yellow. In each panel, an inset box indicates the number of diffraction patterns included in the merge (number of crystals) and summarizes the key data-quality metrics [completeness (%), multiplicity, signal-to-noise ratio, Rsplit (%) (White et al., 2012View full citation), CC1/2 (%) (Assmann et al., 2016View full citation) and overall Rwork and Rfree (%)]. A complete table of data-quality statistics can be found in Supplementary Table S1.

Journal logoSTRUCTURAL
BIOLOGY
ISSN: 2059-7983
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