Table 1 Data collection and refinement statistics.
 | P53_DBD-Azurin |
---|---|
Data collection | |
Wavelength | 0.979 |
Resolution range (Å) | 19.88 – 2.1 |
Space group | C 1 2 1 |
Unit cell | |
 a, b, c (Å) | 144.84 68.75 83.85 |
 α, β, γ (°) | 90.00 99.70 90.00 |
Total reflections | 222394 (15529) |
Unique reflections | 46000(4687) |
Multiplicity | 4.9 (5.0) |
Completeness (%) | 96.18 (99.22) |
I/σ(I) | 7.7 (3.1) |
R-merge (%) | 14.0 (42.9) |
R-meas (%) | 15.6 (48.0) |
R-pim (%) | 6.8 (20.9) |
CC1/2 | 0.989 (0.908) |
Refinement | |
Reflections | 45781 (4684) |
Reflections used for R-free | 2256 (235) |
R-work | 21.3 (28.6) |
R-free | 26.9 (34.7) |
Number of non-hydrogen atoms | 5688 |
 macromolecules | 4967 |
 ligands | 11 |
 solvent | 710 |
Protein residues | 642 |
r.m.s. deviation | Â |
 Bond lengths (Å) | 0.009 |
 Bond angles (°) | 1.28 |
Ramachandran plot | |
 Favored (%) | 97.00 |
 Allowed (%) | 3.00 |
 Outliers (%) | 0.00 |
Average B-factor | 31.48 |
 macromolecules | 31.27 |
 ligands | 46.98 |
 solvent | 32.66 |
PDB ID | 7YGI |