Table 1.

Data collection and refinement statistics for REC114 (15-159).

REC114 nativeREC114 SeMet
Data collection
 Space groupP6122P42212
 Cell dimensions
  a, b, c (Å)107.5, 107.5, 82.888.5, 88.5, 101.5
  α, β, γ (°)90, 90, 12090, 90, 90
 Resolution (Å)93–2.5 (2.57–2.5)a66.7–2.7 (2.8–2.7)
Rmerge5.7 (212.1)12.2 (108.8)
 I/σI24.2 (1.11)11.1 (1.68)
CC1/21 (0.548)0.997 (0.725)
 Completeness (%)99.6 (97.5)100 (99.9)
 Redundancy11.2 (11.1)7.1 (7.1)
Refinement
 Resolution (Å)46.6–2.5
 No. reflections10,215
Rwork/Rfree25 (30)
B-factors77.3
 R.m.s. deviations
 Bond lengths (Å)0.014
 Bond angles (°)1.641
  • a Values in parentheses are for the highest resolution shell.