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 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.9794 |
| Spacegroup name | P 42 21 2 |
| Unit cell lengths | 85.396, 85.396, 104.270 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.192 - 2.050 |
| Rwork | 0.209 |
| R-free | 0.23700 |
| Structure solution method | SAS |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.429 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SOLVE (2.03) |
| Refinement software | REFMAC (refmac_5.2.0005) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.050 |
| High resolution limit [Å] | 1.980 | 4.260 | 1.980 |
| Rmerge | 0.118 | 0.076 | 0.535 |
| Total number of observations | 3017 | 2295 | |
| Number of reflections | 27555 | ||
| Completeness [%] | 98.3 | 99.4 | 83.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | modified microbatch | 5.6 | 298 | 2.5M amonium sulfate, 0.1M sodium citrate, pH 5.6, modified microbatch, temperature 298K |
