Table 1. Data-collection and processing statistics for jrPPO1 crystals.
Space group | C121 |
Wavelength (Å) | 1.033 |
No. of images | 900 |
Oscillation (°) | 0.3 |
Resolution range (Å) | 29.10–2.39 (2.48–2.39) |
Completeness (%) | 99.04 (96.68) |
R merge † | 0.135 (0.514) |
〈I/σ(I)〉 | 8.3 (2.7) |
Multiplicity | 5.04 (4.83) |
Unit-cell parameters (Å, °) | a = 115.56, b = 91.90, c = 86.87, α = 90, β = 130.186, γ = 90 |
R p.i.m. ‡ | 0.067 (0.261) |
CC1/2 | 0.994 (0.938) |
No. of reflections collected | 137555 (12784) |
No. of unique reflections | 27289 (2648) |
R merge = .
R p.i.m. = , where Ii(hkl) is the ith observation of reflection hkl and 〈I(hkl)〉 is the weighted average intensity for all observations of reflection hkl.