Table 3.
X-ray data statistics.
| SufS R56A | SufS R359A | |
|---|---|---|
|
| ||
| 7RRN | 9D2D | |
| Data collection | ||
| Space group | P43212 | P43212 |
| Cell dimensions | ||
| a, b, c (Å) | 126.14, 126.14, 133.27 | 126.14, 126.14, 133.45 |
| α, β, γ (°) | 90, 90, 90 | 90, 90, 90 |
| Wavelength (Å) | 1.54 | 1.54 |
| Resolution (Å)a | 91.99–2.30 (2.36–2.30) | 45.83–2.70 (2.77–2.70) |
| Rmeas (%) | 7.1 (83.8) | 13.3 (85.2) |
| I/σI | 25.93 (1.40) | 19.31 (2.78) |
| Completeness (%) | 98.5 (91.5) | 90.9 (80.1) |
| Redundancy | 10.95 (2.78) | 10.59 (8.50) |
| CC1/2 (%) | 99.9 (63.1) | 99.7 (84.2) |
| Refinement | ||
| Resolution (Å) | 31.79–2.30 (2.36–2.30) | 42.30–2.70 (2.77–2.70) |
| No. reflections | 48316 | 27426 |
| Rwork/Rfree (%) | 20.63 (28.21)/ 23.07(30.45) |
21.03 (34.12)/ 24.47 (37.06) |
| No. atoms | 3165 | 3158 |
| Protein | 3104 | 3113 |
| Ligand | 15 | 15 |
| B factors | 45.27 | 36.88 |
| Protein | 45.30 | 36.90 |
| Ligand | 43.52 | 38.92 |
| R.m.s deviations | ||
| Bond lengths (Å) | 0.008 | 0.008 |
| Bond angles (°) | 0.957 | 0.954 |
Values in parentheses are for the highest-resolution shell.