TABLE 1.
Data collection, phasing, and refinement statisticsa
| Parameter | H6N6-NS1 | H6N6-NS1Δ80-84 |
|---|---|---|
| Data collection statistics | ||
| Space group | P6122 | P21 |
| Unit cell dimensions | ||
| a, b, c (Å) | 101.69, 101.69, 119.53 | 43.87, 120.85, 53.26 |
| α, β, γ (°) | 90.00, 90.00, 120.00 | 90.00, 103.42, 90.00 |
| Wavelength (Å) | 1.0000 | 0.9774 |
| Resolution range (Å) | 88.04–3.16 (3.33∼3.16) | 60.44–2.70 (2.74∼2.70) |
| Rmerge (%) | 0.136 (0.933) | 0.074 (0.906) |
| RPim (%) | 0.042 (0.281) | 0.051 (0.630) |
| Avg I/σ | 12.6 (2.4) | 7.5 (1.0) |
| Completeness (%) | 100 (100) | 94.8 (97.0) |
| Multiplicity | 11.1 (11.7) | 2.8 (2.8) |
| Refinement statistics | ||
| Resolution range (Å) | 88.04–3.16 | 60.44–2.7 |
| No. of reflections | 6,704 | 14,455 |
| Rwork/Rfree | 0.2302/0.2864 | 0.2151/0.2635 |
| No. of atoms | ||
| Protein | 1,527 | 2,943 |
| Ligand/ion | 0 | 0 |
| Water | 0 | 0 |
| B factors (Å2) | ||
| Protein | 60.10 | 74.74 |
| Ligand/ion | NA | NA |
| Water | NA | NA |
| RMSD | ||
| Bond length (Å) | 0.0103 | 0.007 |
| Bond angle (°) | 1.522 | 0.975 |
a
The highest-resolution shell values are shown shown in parenthesis. NA, not applicable.