TABLE 1.
Crystallographic data and refinement statistics for HTNV Gn
| Parameter | Value for the parametera |
|---|---|
| Data collection statistics | |
| Space group | I422 |
| Cell dimensions | |
| a, b, c (Å) | 110.9, 110.9, 180.6 |
| α, β, γ (°) | 90.0, 90.0, 90.0 |
| Resolution range (Å) | 78.42–2.15 (2.21–2.15) |
| Rmerge | 0.195 (>1) |
| I/σ(I) | 14.8 (2.0) |
| CC1/2b | 0.999 (0.883) |
| Completeness (%) | 100 (100) |
| Redundancy | 38.2 (36.4) |
| Refinement statistics | |
| Resolution (Å) | 59.21–2.15 (2.22–2.15) |
| No. reflections | 30,848 (1,574) |
| Rwork/Rfree | 0.201/0.227 |
| No. of atoms | |
| Protein | 2,588 |
| Ligand/ion | 48 |
| Water | 171 |
| B factors (Å2) | |
| Protein | 48.1 |
| Ligand/ion | 68.9 |
| Water | 47.1 |
| RMS deviation | |
| Bond length (Å) | 0.002 |
| Bond angle (°) | 0.447 |
| Ramachandran statistics (%) | |
| Residues in preferred region | 96.04 |
| Residues in allowed region | 3.96 |
| Outliers | 0 |
a
The value for the highest-resolution shell is shown in parentheses.
b
The Pearson correlation coefficient is calculated between two random half data sets.