6LA0
Crystal structure of AoRut
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-5A |
| Synchrotron site | Photon Factory |
| Beamline | BL-5A |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-10-22 |
| Detector | DECTRIS PILATUS3 2M |
| Wavelength(s) | 1.000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 47.908, 169.989, 50.485 |
| Unit cell angles | 90.00, 115.62, 90.00 |
Refinement procedure
| Resolution | 19.570 - 1.750 |
| R-factor | 0.1975 |
| Rwork | 0.196 |
| R-free | 0.23020 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2pf0 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.815 |
| Data scaling software | XDS |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.152) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.850 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmerge | 0.097 | 0.747 |
| Number of reflections | 72840 | 11345 |
| <I/σ(I)> | 13.28 | 2.06 |
| Completeness [%] | 98.9 | 95.4 |
| Redundancy | 5.8 | 5.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 293 | 12% PEG4000, 0.5 M NaAcetate pH4.6 |
