Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2002-08-06 |
Detector | RIGAKU RAXIS IV |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 98.519, 101.556, 52.246 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.340 - 2.280 |
R-factor | 0.253 |
Rwork | 0.253 |
R-free | 0.28200 * |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.009 |
RMSD bond angle | 1.720 * |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.340 | |
High resolution limit [Å] | 2.280 | 2.280 * |
Rmerge | 0.070 * | 0.554 * |
Number of reflections | 24302 | |
Completeness [%] | 98.9 * | 99 * |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 20 * | PEG 3350, CA(AC)2 , pH 7.00, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
Crystallization Reagents
ID | crystal ID | solution ID | reagent name | concentration | details |
1 | 1 | 1 | PEG 3350 | ||
2 | 1 | 1 | CA(AC)2 | ||
3 | 1 | 1 | H2O | ||
4 | 1 | 2 | PEG 3350 | ||
5 | 1 | 2 | CA(AC)2 | ||
6 | 1 | 2 | H2O |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | reservoir | PEG3350 | 15 (%) | |
2 | 1 | reservoir | calcium acetate | 0.2 (M) | |
3 | 1 | reservoir | glycerol | 2.5 (%) | |
4 | 1 | drop | Dpo4 | 6 (mg/ml) | |
5 | 1 | drop | HEPES | 20 (mM) | pH7.0 |
6 | 1 | drop | 5 (mM) | ||
7 | 1 | drop | 150 (mM) |