4MCE
Crystal structure of the Gas5 GRE Mimic
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-05-04 |
Detector | RIGAKU SATURN 944+ |
Wavelength(s) | 1.54 |
Spacegroup name | H 3 |
Unit cell lengths | 43.485, 43.485, 173.188 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 21.743 - 2.205 |
R-factor | 0.19 |
Rwork | 0.181 |
R-free | 0.25840 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 0.764 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.7.1_743)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.240 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.069 | 0.256 |
Number of reflections | 6216 | |
<I/σ(I)> | 5.5 | |
Completeness [%] | 98.8 | 82.1 |
Redundancy | 3.5 | 2.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 298 | 0.05 M sodium succinate pH 5.5 0.5 mM spermine 0.02 M magnesium chloride 3 M ammonium sulfate , VAPOR DIFFUSION, HANGING DROP, temperature 298K |