Table 1.
Crystallographic Data and Refinement Statistics
| Data Collection | |
| Wavelength (λ) | 0.97625 |
| Space group | C2 |
| Cell dimensions | |
| a, b, c (Å) | 120.89, 84.58, 80.14 |
| α, β, γ (°) | 90, 124.31, 90 |
| Resolution (Å) | 50.0−1.87 (1.94−1.87) |
| Total reflections | 1,491,311 |
| Unique reflections | 52503 |
| Overall Rsym (%) | 7.0 (19.9) |
| Overall I/σI | 56.0 (10.1) |
| Completeness (%) | 96.3 (78.5) |
| Mean Redundancy | 6.5 (5.3) |
| Refinement | |
| Rwork/Rfree | 0.225/0.250 |
| Number of atoms | |
| Protein | 3919 |
| Water | 386 |
| B-factors | |
| Protein | 30.4 |
| Water | 34.1 |
| R.m.s deviations | |
| Bond lengths (Å) | 0.007 |
| Bond angles (°) | 1.642 |
| Ramachandran Plot Statistics | |
| Residues in most favored regions | 92.6 % |
| Residues in additional allowed regions | 6.9 % |
| Residues in generously allowed regions | 0.5 % |
| Residues in disallowed regions | 0 |
Highest resolution shell is shown in parenthesis. Rwork = Σ|Fo−Fc|/ΣFo. Rfree is the cross-validation of R-factor, with 5% of the total reflections omitted in model refinement.