Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
Synchrotron site | Australian Synchrotron |
Beamline | MX2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-10-01 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.2398 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 51.268, 68.643, 62.537 |
Unit cell angles | 90.00, 105.72, 90.00 |
Refinement procedure
Resolution | 19.260 - 3.200 |
R-factor | 0.1876 |
Rwork | 0.185 |
R-free | 0.24240 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1z2w |
RMSD bond length | 0.011 |
RMSD bond angle | 1.377 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.6.1_357)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.700 | 3.370 |
High resolution limit [Å] | 3.200 | 3.200 |
Rmerge | 0.106 | 0.475 |
Number of reflections | 6568 | |
<I/σ(I)> | 10.2 | 3.5 |
Completeness [%] | 99.5 | 100 |
Redundancy | 5.1 | 5.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.6 | 289 | 0.1M Tris, 0.2M NaCl, 20% PEG 3350, pH 8.6, VAPOR DIFFUSION, SITTING DROP, temperature 289K |