From: The crystal structure of superoxide dismutase from Plasmodium falciparum
 | PfFeSod (PDB code 2BPI) |
---|---|
Data collection | |
X-ray source | ESRF Beamline ID29 |
Wavelength (Ã…) | 0.976000 |
Collection Temperature (K) | 100 |
Resolution range (Å) | 25.00 – 2.52 |
Space group | P 212121 |
Unit-cell parameters (Ã…) | a = 55.94, b = 78.91, c = 90.62 |
Matthews coefficient/solvent content (%) | 2.2/43.0 |
Number of unique reflections, overall/outer shella | 13247 (843) |
Completeness (%), overall/outer shella | 98.8 (100) |
Redundancy, overall/outer shella | 4.1 (4.2) |
I/σ(I), overall/outer shella | 17.3 (6.2) |
Rmergeb (%), overall/outer shella | 8.3 (29.7) |
Refinement and model statistics | |
R-factorc | 0.187 (0.224) |
R-freed | 0.263 (0.338) |
Molecules/asymmetric unit | 2 |
Number of protein non hydrogen atoms | 3345 |
Number of water molecules | 140 |
Rms deviation from targete | Â |
   Bond lengths (Å) | 0.014 |
   Bond angles (°) | 1.453 |
Average B-factor (Ã…2) | 28.10 |
Ramachandran plotf | 90.3/8.6/0.6/0.6 |