Table 1. Crystallographic data and refinement statistics.
| Data collection | |
| Data set | hTRβ/GC-24 |
| Resolution, Å | 2.8 (2.98-2.8) |
| Space group | P6522 |
| Cell dimensions, Å | |
| a | 56.57 |
| b | 56.57 |
| c | 390.05 |
| Observed reflections | 113,019 |
| Unique reflections | 9,368 |
| Completeness, % | 93 (81.5) |
| Rsym, %* | 6.9 (16.1) |
| 〈I/O〉 | 15.8 (5.1) |
| Refinement | |
| Rcryst, %† | 21.6 (28.1) |
| Rfree, %‡ | 26.4 (36.9) |
| rmsd for bond lengths, Å | 0.011 |
| rmsd for angles, Å | 1.6 |
| Average B factor, Å2 | 59.8 |
Values in parentheses refer to the highest-resolution shell. rmsd, rms deviation.
*
Rsym = ΣhΣi|Ih,i - 〈Ih〉|/ΣIh for the intensity (I) of i observations of reflection h.
†
Rcryst = Σ|Fobs - Fcalc|/Σ|Fobs|.
‡
Rfree is calculated in the same way as Rcryst, using 5% of the reflections that were set aside for cross-validation and not used in refinement.