Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-04-24 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1.0 |
Spacegroup name | P 41 3 2 |
Unit cell lengths | 228.116, 228.116, 228.116 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 24.889 - 3.850 |
R-factor | 0.2226 |
Rwork | 0.219 |
R-free | 0.29660 |
Structure solution method | SAD |
RMSD bond length | 0.003 |
RMSD bond angle | 0.702 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.000 | 4.220 |
High resolution limit [Å] | 3.850 | 3.850 |
Rpim | 0.076 | 0.727 |
Number of reflections | 19830 | 4618 |
<I/σ(I)> | 7.6 | |
Completeness [%] | 99.6 | |
Redundancy | 9.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 295 | 32% PEG400, 0.05 M sodium acetate, 0.1 M magnesium acetate, 3.6 mM decyl beta-D-maltoside |