Extended data Table 1. Data collection and refinement statistics.
*Values in parentheses are for highest-resolution shell.
A single crystal was used for each dataset.
| Active MfR2 | Inactive MfR2 (aerobic) | Inactive MfR2 (anaerobic) | |
|---|---|---|---|
| Data collection | |||
| Space group | C2 | C2 | C2 |
| Cell dimensions | |||
| a, b, c (Å) | 176.16, 53.74, 79.28 | 176.19, 53.43, 79.13 | 176.30 53.51 79.10 |
| α, β, γ (°) | 90, 108.58, 90 | 90, 108.53, 90 | 90 108.49 90 |
| Resolution (Å) | 42.73-1.48 (1.53-1.48)* | 42.71-1.23 (1.27-1.23) | 44. 19-1.24 (1.28-1.24) |
| Rmerge | 0.066 (1.403) | 0.054 (1.092) | 0.052 (0.951) |
| I / σI | 12.67 (1.17) | 15.13 (1.35) | 15.15 (1.50) |
| Completeness (%) | 99.8 (99.7) | 98.9 (97.3) | 97.4 (94.4) |
| Redundancy | 6.6 (6.4) | 6.4 (6.0) | 6.5 (6.2) |
| Refinement | |||
| Resolution (Å) | 42.73-1.43 (1.53-1.43) | 42.71-1.23 (1.27-1.23) | 44. 19-1.24 (1.28-1.24) |
| No. reflections | 117311 (11659) | 200307 (19622) | 192936 (18564) |
| Rwork / Rfree | 0.1543 (0.3738) / 0.1845 (0.4083) | 0.1466 (0.3296) / 0.1688 (0.3434) | 0.1472 (0.3008) / 0.1630 (0.3105) |
| No. atoms | 6137 | 6848 | 6743 |
| Protein | 5610 | 6128 | 6097 |
| Ligand/ion | 2 | 2 | 2 |
| Water | 525 | 718 | 644 |
| B-factors | 39.00 | 27.28 | 28.61 |
| Protein | 38.07 | 25.71 | 27.45 |
| Ligand/ion | 29.44 | 20.44 | 22.58 |
| Water | 48.89 | 40.65 | 39.67 |
| R.m.s. deviations | |||
| Bond lengths (Å) | 0.007 | 0.006 | 0.006 |
| Bond angles (°) | 1.13 | 1.12 | 1.13 |