3F4S
Crystal structure of Wolbachia pipientis alpha-DsbA1 T172V
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E+ SUPERBRIGHT |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2006-09-07 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 70.730, 49.610, 69.000 |
Unit cell angles | 90.00, 106.33, 90.00 |
Refinement procedure
Resolution | 66.216 - 1.550 |
R-factor | 0.155 |
Rwork | 0.151 |
R-free | 0.19400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3f4r |
RMSD bond length | 0.005 |
RMSD bond angle | 0.886 |
Data reduction software | CrystalClear |
Data scaling software | CrystalClear |
Phasing software | CNS |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 66.330 | 1.610 |
High resolution limit [Å] | 1.550 | 1.550 |
Rmerge | 0.036 | 0.281 |
Number of reflections | 31734 | |
<I/σ(I)> | 15.1 | 2.6 |
Completeness [%] | 94.9 | 62 |
Redundancy | 2.9 | 2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 22% PEG 3350, 0.1M Ammonium citrate pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |