Table 1.
Data processing and refinement statistics.
| Parameters | AtNRP2 |
|---|---|
| Data collection and Processing | |
| Beam line | ID30A-3, ESRF, Grenoble, France |
| Detector type | Dectris pixel (Eiger_4M) |
| Wavelength (Å) | 0.9794 |
| Data Collection temperature (K) | 100 K |
| Space Group | H32 |
| α,β,γ a,b,c |
90.00°, 90.00°, 120.00° 123.45 Å, 123.45 Å, 228.71 Å |
| Resolution (Å) | 42.04–3.42 (3.50–3.42) |
| Rmerge (%) | 13% (51%) |
| I/σI | 1.93 |
| CC (1/2) | 0.999 (0.722) |
| Total number of reflections | 105,656 (10,947) |
| Completeness (%) | 99.69 (100.00) |
| Multiplicity | 11.4 |
| Wilson B factor (Å2) | 116.5 |
| Average B, all atoms (Å2) | 90.0 |
| Anisotropy | 0.027 |
| Number of molecules in asymmetric unit | 2 |
| Refinement | |
| Number of unique reflections | 9304 (914) |
| R work/R free (%) | 0.272/0.320 (0.277/0.327) |
| Total number of non-H atoms | 2346 |
| r.m.s. deviations: Bond lengths (Å) Bond angles (o) |
0.004 0.96 |
| Ramachandran plot values (%) Favored/Outliers | 99.04/0.96 |
Values in parenthesis are for the highest resolution shell.