Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-1 |
Synchrotron site | SSRL |
Beamline | BL9-1 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 1999-04-26 |
Detector | MARRESEARCH |
Spacegroup name | P 65 |
Unit cell lengths | 169.500, 169.500, 113.800 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 50.000 - 2.600 |
R-factor | 0.266 * |
Rwork | 0.266 |
R-free | 0.29800 |
Structure solution method | MIR |
RMSD bond length | 0.023 |
RMSD bond angle | 19.450 * |
Data reduction software | MOSFLM |
Data scaling software | CCP4 ((TRUNCATE)) |
Phasing software | MLPHARE |
Refinement software | X-PLOR |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.690 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.051 | 0.410 |
Total number of observations | 264392 * | |
Number of reflections | 57348 | |
<I/σ(I)> | 9.9 | 1.7 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 3.8 | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 * | 293 | 1.8 M (NH4)2SO4, 20 mM MgCl2, 50 mM Potassium Cacodylate, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
Crystallization Reagents
ID | crystal ID | solution ID | reagent name | concentration | details |
1 | 1 | 1 | MgCl2 | ||
2 | 1 | 1 | Potassium Cacodylate | ||
3 | 1 | 1 | (NH4)2SO4 | ||
4 | 1 | 2 | (NH4)2SO4 |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | reservoir | ammonium sulfate | 1.8 (M) | |
2 | 1 | reservoir | 20 (mM) | ||
3 | 1 | reservoir | potassium cacodylate | 50 (mM) |