1WGJ
STRUCTURE OF INORGANIC PYROPHOSPHATASE
Experimental procedure
Detector technology | IMAGE PLATE |
Detector | RIGAKU |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 59.100, 103.800, 117.200 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 8.000 - 2.000 |
R-factor | 0.172 |
Rwork | 0.172 |
R-free | 0.20300 |
RMSD bond length | 0.011 |
RMSD bond angle | 25.000 * |
Data reduction software | DENZO |
Phasing software | X-PLOR (3.1) |
Refinement software | X-PLOR (3.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 8.000 * | |
High resolution limit [Å] | 2.000 * | 2.000 * |
Rmerge | 0.103 | |
Total number of observations | 236904 * | |
Number of reflections | 45565 * | |
Completeness [%] | 89.2 * | 82.9 * |
Redundancy | 5.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Vapor diffusion, sitting drop * | 6 * |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | MES | 30 (mM) | |
2 | 1 | drop | 1 (mM) | ||
3 | 1 | drop | sodium hydrogen phosphate | 1 (mM) | |
4 | 1 | drop | MPD | 17 (%) | |
5 | 1 | reservoir | MPD | 19 (%) |