Table 1.
Data Collection and Refinement Statistics
| SARS-CoV-2-CTD and hACE2 | |
|---|---|
| Data Collection | |
| Space group | P41212 |
| Cell Dimensions | |
| a, b, c (Å) | 104.45, 104.45, 229.79 |
| a, b, c (°) | 90.00, 90.00, 90.00 |
| Resolution (Å) | 50.00–2.50 (2.59–2.50) |
| Unique reflections | 44,981 (43,84) |
| Completeness (%) | 100.0 (100.0) |
| Rmerge | 0.129 (1.147) |
| I/σI | 26.7 (3.3) |
| CC1/2 (%) | 0.999 (0.867) |
| Redundancy | 21.6 (22.3) |
| Refinement | |
| Resolution (Å) | 34.50-2.50 |
| Number of reflections | 44861 |
| Rwork/Rfree | 0.1846/0.2142 |
| Number of Atoms | |
| Protein | 6,461 |
| Ligand/ion | 1 |
| Water | 322 |
| B-factors | |
| Protein | 44.1 |
| Ligand/ion | 38.3 |
| Water | 40.4 |
| RMSDs | |
| Bond lengths (Å) | 0.005 |
| Bond angles (°) | 0.799 |
| Ramachandran Statistics (%) | |
| Favored | 98.60 |
| Allowed | 1.02 |
| Disallowed | 0.38 |
Values in parentheses are for the highest-resolution shell.