Table 1. Diffraction data and refinement statistics.
| TcPINK1 (Native) | |
|---|---|
| Data collection | |
| Space group | P1 21 1 |
| Cell dimensions | |
| a, b, c (Å) | 84.92 116.74 179.34 |
| α, b, g (°) | 90.00 94.29 90.00 |
| Wavelength (Å) | 1.03 |
| Resolution (Å) | 178.84–2.78 (2.83–2.78)* |
| Rmerge | 8.5 (122.4) |
| I/σ(I) | 13.0 (1.4) |
| CC1/2 | 99.9 (59.4) |
| Completeness (%) | 99.9 (99.8) |
| Redundancy | 6.7 (6.8) |
| Refinement | |
| Resolution (Å) | 178.84 (2.78) |
| No. reflections | 83545 |
| Rwork/Rfree | 20.6/24.5 |
| No. atoms | |
| Protein | 16722 |
| Ligand/ion | 6 |
| Water | 30 |
| B factors | |
| Protein | 80.8 |
| Ligand/ion | 81.6 |
| Water | 70.9 |
| R.m.s. deviations | |
| Bond lengths (Å) | 0.01 |
| Bond angles (°) | 1.8 |
Single crystals were used for structure determination.
*Values in parentheses are for highest-resolution shell.