Table 3:
X-ray data collection and refinement statistics (molecular replacement)
| SARS-CoV-2 NNTD | |
|---|---|
| Data collection | |
| Wavelength (Å) | 0.9794 |
| Space group | P 212121 |
| Cell dimensions | |
| a, b, c (Å) | 58.76, 92.76, 95.59 |
| α, β, γ (°) | 90, 90, 90 |
| Resolution range (Å) | 37–1.70 |
| Rsym or Rmerge | 0.024(0.65)* |
| I /σ/-CC1/2 | 27.5(1.1)-99(42) |
| Completeness (%) | 98.9(98.2) |
| Redundancy | 11(7) |
| Refinement | |
| Refinement program | COOT |
| Resolution range (Å) | 37–1.70 |
| No. reflections | 59316 |
| Rwork/Rfree | 24.4/28.5 |
| No. of nonhydrogen atoms | |
| Protein | 3642 |
| Solvent (water) | 650 |
| B-factors | |
| Protein | 48.5 |
| Solvent (water) | 42 |
| R.m.s. deviations | |
| Bond lengths (Å) | 0.003 |
| Bond angles (°) | 0.68 |
| PDB ID | 7UW3 |
Values in parentheses are for highest-resolution shell.