Table 1.
Data collection and refinement statistics
| Data collection | LCPBsYetJ | D171EBsYetJ | D195EBsYetJ |
|---|---|---|---|
| Wavelength (Å) | 0.979 | 0.979 | 1.1 |
| Space group | P21 | C2 | C2 |
| Cell dimensions | 33.86, 62.04, 47.34 | 218.09, 117.30, 52.41 | 217.33, 118.20, 51.89 |
| a, b, c (Å) β (°) |
93.95 | 92.96 | 93.23 |
| Solvent content (%) | 44.0 | 65.0 | 65.1 |
| Bragg spacings (Å) | 37.39-2.50 (2.63-2.50) |
47.15-3.10 (3.31-3.10) |
39.96-3.1 (3.31-3.10) |
| Total reflections | 46387 | 76248 | 92561 |
| Unique reflections | 6634 | 23721 | 23817 |
| Completeness (%) | 95.3 (78.4) | 99.1 (99.7) | 99.8 (99.9) |
| I/σ(I) | 6.0 (2.4) | 5.4 (1.1) | 6.0 (1.1) |
| Rmeas | 0.218 (0.939) | 0.266 (1.429) | 0.312 (2.124) |
| Multiplicity | 7.0 (6.5) | 3.2 (3.2) | 3.9 (3.9) |
| CC1/2 | 97.3 (77.0) | 98.1 (36.6) | 98.6 (37.2) |
| Refinement | |||
| Resolution (Å) | 2.5 | 3.1 | 3.1 |
| No. reflections | 6273 | 23641 | 23799 |
| Rwork/Rfree | 0.243/0.260 | 0.243/0.271 | 0.247/0.276 |
| No. atoms | 1624 | 6430 | 6416 |
| Protein | 1592 | 6430 | 6416 |
| Water | 31 | - | - |
| Average B (Å2) | 39.6 | 61.53 | 68.0 |
| Protein | 39.5 | 61.53 | 68.0 |
| Water | 44.0 | - | - |
| R.m.s deviations | |||
| Bond length (Å) | 0.007 | 0.002 | 0.002 |
| Bond angle (°) | 0.986 | 0.454 | 0.409 |
| PDB code | 6NQ7 | 6NQ8 | 6NQ9 |