Skip to main content
. 2020 Sep 15;76(Pt 10):483–487. doi: 10.1107/S2053230X20011814

Table 1. Room-temperature neutron and X-ray data-collection statistics.

  X-ray Neutron
Unit-cell parameters (Å, °) a = 114.93, b = 54.69, c = 45.22, α = 90, β = 101.46, γ = 90
Space group C2
Wavelength(s) (Å) 1.54 2–4.16
No. of unique reflections 12092 (1155) 7995 (765)
Resolution range (Å) 28.16–2.30 (2.38–2.30) 14.95–2.50 (2.59–2.50)
Multiplicity 4.30 (3.70) 5.67 (4.68)
I/σ(I)〉 8.6 (1.7) 13.0 (3.70)
CC1/2 0.993 (0.480) 0.961 (0.551)
R p.i.m. 0.069 (0.544) 0.078 (0.156)
Data completeness (%) 98.20 (96.60) 83.93 (83.33)