1I6A
CRYSTAL STRUCTURE OF THE OXIDIZED FORM OF OXYR
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU300 |
Temperature [K] | 298 |
Detector technology | IMAGE PLATE |
Detector | RIGAKU RAXIS IIC |
Wavelength(s) | 1.54 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 96.830, 45.850, 53.420 |
Unit cell angles | 90.00, 117.90, 90.00 |
Refinement procedure
Resolution | 100.000 - 2.300 |
R-factor | 0.169 * |
Rwork | 0.169 |
R-free | 0.21600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | reduced form of OxyR |
RMSD bond length | 0.008 |
RMSD bond angle | 24.100 * |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | CNS |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 100.000 |
High resolution limit [Å] | 2.300 |
Rmerge | 0.064 * |
Number of reflections | 9049 |
Completeness [%] | 99.2 * |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 25 * | VAPOR DIFFUSION, HANGING DROP |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 30 (mg/ml) | |
2 | 1 | reservoir | PEG10000 | 8-12 (%) | |
3 | 1 | reservoir | CAPS | 0.2 (M) | |
4 | 1 | reservoir | benzoic acid | 0.1 (M) | |
5 | 1 | reservoir | Tris | 0.1 (M) |