1F4N
C2 CRYSTAL STRUCTURE OF ALA2ILE2-6, A VERSION OF ROP WITH A REPACKED HYDROPHOBIC CORE AND A NEW FOLD.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 105 |
Detector technology | IMAGE PLATE |
Collection date | 1998-09-21 |
Detector | RIGAKU RAXIS IV |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 82.617, 36.488, 47.727 |
Unit cell angles | 90.00, 121.20, 90.00 |
Refinement procedure
Resolution | 40.820 - 1.900 |
R-factor | 0.204 * |
Rwork | 0.204 |
R-free | 0.23700 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.200 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.820 | 1.970 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.055 | 0.238 |
Number of reflections | 9460 | |
<I/σ(I)> | 12.6 | |
Completeness [%] | 96.9 | 84 |
Redundancy | 6.7 | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 294 | MPD, calcium chloride, sodium HEPES, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 294K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 18 (mg/ml) | |
2 | 1 | reservoir | MPD | 18-22 (%) | |
3 | 1 | reservoir | 50-100 (mM) | ||
4 | 1 | reservoir | sodium HEPES | 100 (mM) |