Table 1.
Data Collection and Refinement Statistics
| VcSiaP Q54R1/L173R1 | |
|---|---|
| Wavelength | 0.89429 |
| Resolution range | 45.29–2.101 (2.176–2.101) |
| Space group | P 21 2 21 |
| Unit cell | 72.3 78.1 116.2 90 90 90 |
| Total reflections | 73,484 (6631) |
| Unique reflections | 37,987 (3606) |
| Multiplicity | 1.9 (1.8) |
| Completeness (%) | 97 (94) |
| Mean I/σ(I) | 7.25 (1.18) |
| Wilson B-factor | 40.2 |
| R-merge | 0.043 (0.51) |
| R-meas | 0.061 (0.73) |
| CC1/2 | 0.997 (0.507) |
| CC∗ | 0.999 (0.82) |
| Reflections used in refinement | 37,954 (3605) |
| Reflections used for R-free | 2019 (188) |
| R-work | 0.222 (0.357) |
| R-free | 0.259 (0.359) |
| CC(work) | 0.967 (0.517) |
| CC(free) | 0.957 (0.438) |
| RMS(bonds) | 0.005 |
| RMS(angles) | 0.78 |
| Ramachandran favored (%) | 98 |
| Ramachandran allowed (%) | 1.5 |
| Ramachandran outliers (%) | 0 |
| Rotamer outliers (%) | 0.78 |
| Clashscore | 7.60 |
| PDB-ID | 5LTC |
Values in parentheses correspond to the shell of highest resolution.