Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.3.1 |
| Synchrotron site | ALS |
| Beamline | 8.3.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2018-04-25 |
| Detector | ADSC QUANTUM 210r |
| Wavelength(s) | 1.01 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 44.409, 43.375, 58.715 |
| Unit cell angles | 90.00, 111.97, 90.00 |
Refinement procedure
| Resolution | 23.060 - 1.800 |
| R-factor | 0.206 |
| Rwork | 0.203 |
| R-free | 0.23770 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6C03 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.898 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.6.4_486) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 23.060 | 1.910 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmeas | 0.075 | 0.170 |
| Rpim | 0.044 | 0.101 |
| Number of reflections | 29209 | |
| <I/σ(I)> | 10 | 3.9 |
| Completeness [%] | 92.8 | 99.3 |
| Redundancy | 2.5 | 2.6 |
| CC(1/2) | 0.996 | 0.977 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 298 | 0.2 M ammonium nitrate, 26% PEG 3500 |
