Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-BM |
| Synchrotron site | APS |
| Beamline | 19-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2019-04-11 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97935 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 46.915, 170.299, 89.947 |
| Unit cell angles | 90.00, 89.98, 90.00 |
Refinement procedure
| Resolution | 46.910 - 2.700 |
| R-factor | 0.1911 |
| Rwork | 0.188 |
| R-free | 0.24860 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6dpz |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.477 |
| Data reduction software | HKL-3000 |
| Data scaling software | SCALEPACK |
| Phasing software | HKL-3000 |
| Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.750 |
| High resolution limit [Å] | 2.700 | 7.320 | 2.700 |
| Rmerge | 0.160 | 0.069 | 0.944 |
| Rmeas | 0.178 | 0.077 | 1.053 |
| Rpim | 0.077 | 0.034 | 0.459 |
| Total number of observations | 185370 | ||
| Number of reflections | 38507 | 1943 | 1988 |
| <I/σ(I)> | 5.2 | ||
| Completeness [%] | 99.8 | 98.1 | 100 |
| Redundancy | 4.8 | 4.6 | 4.7 |
| CC(1/2) | 0.991 | 0.687 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.5 | 289 | 0.1M HEPES, 10% 2-propanol, 20% PEG4000 |
