3ESF
Crystal Structure of the enzyme Fe-superoxide dismutase TbSODB2 from Trypanosoma brucei
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2006-05-01 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.54 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 68.302, 76.504, 76.981 |
Unit cell angles | 90.00, 92.70, 90.00 |
Refinement procedure
Resolution | 30.180 - 2.010 |
R-factor | 0.17721 |
Rwork | 0.175 |
R-free | 0.21911 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2gpc |
RMSD bond length | 0.014 |
RMSD bond angle | 1.418 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.300 | 2.059 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.080 | 0.298 |
Number of reflections | 52751 | |
<I/σ(I)> | 3.8 | |
Completeness [%] | 98.4 | 89.7 |
Redundancy | 4.4 | 2.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | hanging drop | 8.5 | 291 | 0.1 M Tris pH 8.5, 24-30% PEG4000 and 0.2 M MgCl2, hanging drop, temperature 291K |