Table 1. Crystallographic data reduction and model refinement statistics.
Crystal parameters | |
Space group | P 21 |
Unit cell | a = 51.439 Å, b = 175.176 Å, c = 97.065 Å, β = 95.3° |
Data Collection | |
Resolution | 39.9-2.05 Å (2.12-2.05)* |
Unique reflections | 101735 (9604) |
Redundancy | 3.4 (3.3) |
Completeness | 95.32% (90.60%) |
Rmerge | 6.7% (53.0%) |
I/σ(I) | 6.04 (1.77) |
Refinement statistics | |
Rwork | 18.18% (28.74%) |
Rfree | 22.62% (33.17%) |
No. atoms (protein/solvent) | 10996/553 |
r.m.s.d. | |
Bonds | 0.014 Å |
Angles | 1.39° |
Average B-factor | |
Protein | 47.5 Å2 |
Solvent | 45.8 Å2 |
Ramachandran Statistics | |
Favored | 97.0% |
Allowed | 3.0% |
Values in parentheses are for highest resolution bin.