Table 1. Data collection and refinement statistics.
t | |
Space group | R32 |
Cell dimensions | |
a, c (Å) | 119.83,367.76 |
Resolution (Å) | 40–1.75 (1.81–1.75)* |
Rsym | 0.091 (0.732) |
I / σI | 29.1 (3.2) |
Completeness (%) | 99.9 (100) |
Redundancy | 8.6 (8.5) |
Refinement | |
Resolution (Å) | 36.08–1.75 |
No. reflections | 99,891 |
Rwork / Rfree | 16.85/19.05 |
No. atoms | |
Protein | 6,039 |
Ligand/ion | 4 |
Water | 684 |
B-factors | |
Protein | 28.1 |
Water | 31.5 |
R.m.s. deviations | |
Bond lengths (Å) | 0.012 |
Bond angles (°) | 1.457 |
*Values in parentheses are for the highest-resolution shell.