Table 1.
Parameter | Value for BNPb |
---|---|
Data collection statistics | |
Space group | I 2 2 2 |
Cell dimensions | |
a, b, c (Å) | 106.95, 123.34, 198.08 |
α, β, γ (°) | 90.00, 90.00, 90.00 |
Resolution (Å) | 104.73–3.23 (3.35–3.23)a |
Rsym or Rmerge | 0.113 (0.387) |
I /σI | 13.8 (2.9) |
Completeness (%) | 93.2 (95.1) |
Redundancy | 7.2 (7.3) |
Refinement statistics | |
Resolution range (Å) | 47.055–3.233 |
No. of reflections | 19,862 |
Rwork/Rfree | 0.245/0.291 |
No. of atoms | 7022 |
B-factors | 77.10 |
RMSD | |
Bond lengths (Å) | 0.002 |
Bond angles (°) | 0.729 |
Ramachandran plot (%) | |
Most favored | 88.5 |
Additional allowed | 9.0 |
Generously allowed | 2.5 |
Disallowed | 0.0 |
Data from a single crystal.
Values in parentheses are for highest-resolution shell.