Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-03-29 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.3779 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 84.237, 111.008, 258.867 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 36.630 - 3.780 |
R-factor | 0.2822 |
Rwork | 0.280 |
R-free | 0.32350 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 1.188 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 4.030 |
High resolution limit [Å] | 3.780 | 7.690 | 3.780 |
Rmerge | 0.084 | 0.042 | 0.467 |
Number of reflections | 21143 | ||
<I/σ(I)> | 7.2 | ||
Completeness [%] | 96.8 | 99.9 | 84.9 |
Redundancy | 3.7 | 3.7 | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 298 | 15%PEG1000, 360mM Lithium Citrate, 5% Glycerol, 5% Isopropanol, pH 6.5,, VAPOR DIFFUSION, HANGING DROP, temperature 298K |