Table 1.
Data collection and refinement statistics
| A2A-T4L-ΔC | |
|---|---|
| Data collection (APS GM/CA CAT ID-B, 10 μm beam) | |
| Space group | P21 |
| Cell dimensions | |
| a, b, c (Å) | 47.7, 76.9, 86.6 |
| (°) | 101.3 |
| No. of reflections processed | 64,526 (8165) |
| No. unique reflections | 18,465 (356) |
| Resolution (Å) | 20.0 - 2.6 (2.8 - 2.6) |
| Rsym | 9.8 (38.9) |
| Mean I/σ(I) | 7.0 (2.3) |
| Completeness (%) | 96.8 (93.9) |
| Multiplicity | 3.5 (2.3) |
| Refinement | |
| Resolution (Å) | 20.0 - 2.6 |
| No. reflections (reference set) | 18,461 (937) |
| Rcrys / Rfree | 19.6 / 23.1 |
| No. atoms | 3769 |
| Protein | 3521 |
| Ions, lipids, ligand and other | 165 |
| Water oxygen | 83 |
| B-values (Å2) | |
| All atoms | 70.6 |
| Protein | 69.4 |
| Ligand | 66.7 |
| Lipid | 94.4 |
| R.m.s deviations from ideality | |
| Bond lengths (Å) | 0.002 |
| Bond angles (°) | 0.78 |
| Ramachandran plot statistics (%) (excl. Gly, Pro): | |
| Most favored regions | 92.8 |
| Additionally allowed regions | 7.2 |
| Generously allowed regions | 0.0 |
| Disallowed regions | 0.0 |
*
Highest resolution shell is shown in parenthesis.
Rsym = 100 Σn (ΣI |Ii - Î|)/Σn (Σ Ii)
Rcrys = 100 Σhkl |Fobs - Fcalc| Σhkl Fobs.
Rfree = test set 5%.