Table 1.
Data collection and refinement statistics.
| Truncated C3PO (SeMet) | ||
|---|---|---|
| Data collection | ||
| Space group | P6122 | |
| Cell dimensions | ||
| a, b, c (Å) | 196.03, 196.03, 155.19 | |
| α, β, γ(°) | 90, 90, 120 | |
| Inflection | Peak | |
| Wavelength (Å) | 0.9794 | 0.9792 |
| Resolution (Å) | 30.0–3.4 (3.52–3.40) | 50.0–3.8 (3.94–3.80) |
| Rsym or Rmerge | 21.4 (86.5) | 24.0 (85.3) |
| I/σI | 11.4 (2.7) | 10.8 (2.4) |
| Completeness (%) | 99.8 (99.8) | 99.9 (99.9) |
| Redundancy | 14.4 (11.0) | 21.4 (15.8) |
| Refinement | ||
| Resolution (Å) | ||
| low resolution | 20 | |
| high Resolution (a*, b*, c*)# | 3.9, 3.9, 3.4 | |
| No. of Reflections (total/test) | 19572/999 | |
| Rwork/Rfree | 27.0/33.8 | |
| No. atoms | ||
| Protein | 4718 | |
| Ligand/ion | - | |
| Water | - | |
| B-factors | ||
| Protein | 89.4 | |
| R.m.s deviations | ||
| Bond lengths (Å) | 0.016 | |
| Bond angles (°) | 0.864 | |
One crystal was used for both data sets.
Values for highest resolution shell are shown in parenthesis.
#
After anisotropic correction, high resolution data beyond these limits were excluded during refinement.