Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Detector technology | CCD |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.969 |
Spacegroup name | P 41 2 2 |
Unit cell lengths | 78.804, 78.804, 114.885 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 2.300 |
R-factor | 0.20678 |
Rwork | 0.206 |
R-free | 0.23292 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 1XQU |
RMSD bond length | 0.016 |
RMSD bond angle | 1.765 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | REFMAC |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 20.000 |
High resolution limit [Å] | 2.300 |
Number of reflections | 16265 |
Completeness [%] | 98.0 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 291 | 20% w/v PEG 3000, 0.2M sodium chloride, 0.1M HEPES, pH 7.5 |