Table 1.
Data collection | |
Source | NSLS X12C |
Space group | P21212 |
Cell dimenstions | |
a, b, c (Å) | 183.69, 73.36, 110.78 |
α, β, γ (°) | 90, 90, 90 |
Resolution | 50–2.8 |
Wavelength (Å) | 0.979 |
Unique reflections | 35,508 |
Redundancy | 5.2 (4.4)a |
Completeness (%) | 94.4 (92.5) |
Rmerge (%) | 13.2 (51.0) |
I/σ(I) | 11.9 (2.7) |
Refinement | |
Resolution | 30–3.0 |
Rwork (%) | 23.5 |
Rfree (%) | 28.6 |
No. of molecules | |
Protein | 9414 |
Water | 6 |
B-factors | |
Protein | 47.4 |
Water | 25.5 |
r.m.s.d. | |
Bond lengths (Å) | 0.006 |
Bond angles (o) | 1.1 |
Ramachandran plot | |
Most favored (%) | 84.6 |
Additionally allowed (%) | 14.6 |
Generously allowed (%) | 0.6 |
Disallowed (%) | 0.2 |
Values in parentheses correspond to statistics for the (3.15–3.02 Å) resolution shell.