| Parameters |
Cyp-apo |
Cyp-CsA |
| Data collection statistics |
|
|
| Space group |
I222 |
P4212 |
| Unit cell parameters (Å) a,b, c |
37.85, 98.20, 111.68 |
103.97, 103.97, 61.28 |
| Resolution range (Å) |
49.08-1.85 (-1.95-1.85) |
34.65-1.47 (1.55-1.47) |
| Measured reflections |
75797 (10687) |
381226 (50155) |
| Unique reflections |
18133 (2582) |
57546 (8279) |
| Completeness (%) |
99.5 (99.5) |
99.9 (99.9) |
| Redundancy |
4.2 (4.1) |
6.6 (6.1) |
| Average I/s(I) |
9.7 (2.2) |
14.2 (2.3) |
| Rmeas (%) |
16.6 (64.9) |
9.0 (72.3) |
| Rsym (%) |
14.5 (56.8) |
8.3 (66.0) |
| Refinement statistics |
|
|
| Reflection in working set |
17087 |
54396 |
| Reflections in test set |
868 |
2759 |
| Rwork/Rfree (%) |
17.44/20.50 |
17.44/20.78 |
| R.m.s.d. bonds (Å) |
0.006 |
0.008 |
| R.m.s.d. angles (º) |
1.005 |
1.857 |
| Ramachandran plot (%) |
|
|
| Favored |
96.30 |
96.01 |
| Allowed |
3.70 |
3.38 |
| Disallowed |
0 |
0.61 |
The values in parentheses refer to statistics in the highest bin. |