Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-11-18 |
| Detector | DECTRIS PILATUS3 R 200K-A |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 45.090, 66.005, 45.002 |
| Unit cell angles | 90.00, 97.61, 90.00 |
Refinement procedure
| Resolution | 33.920 - 1.950 |
| R-factor | 0.2114 |
| Rwork | 0.209 |
| R-free | 0.25160 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6vzk |
| RMSD bond length | 0.002 |
| RMSD bond angle | 1.181 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.990 |
| High resolution limit [Å] | 1.950 | 5.320 | 1.960 |
| Rmerge | 0.130 | 0.108 | 0.485 |
| Rmeas | 0.161 | 0.137 | 0.599 |
| Rpim | 0.094 | 0.083 | 0.346 |
| Number of reflections | 17848 | 959 | 757 |
| <I/σ(I)> | 9.5 | ||
| Completeness [%] | 93.8 | 96.6 | 82.7 |
| Redundancy | 2.7 | 2.4 | 2.5 |
| CC(1/2) | 0.957 | 0.758 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.2 | 277 | 0.1M 1,3-bis(tris(hydroxymethyl)methylamino)propane, 0.1 M Ammonium sulfate, 20% PEG 3350, 5% Ethanol |
