7A9E
tRNA-guanine transglycosylase C158S/C281S/Y330C/H333A mutant in complex with ethyl methyl sulfone
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.1 |
| Synchrotron site | BESSY |
| Beamline | 14.1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-12-08 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.91841 |
| Spacegroup name | P 65 2 2 |
| Unit cell lengths | 127.998, 127.998, 115.379 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 42.850 - 1.760 |
| R-factor | 0.1828 |
| Rwork | 0.182 |
| R-free | 0.20460 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1pud |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.790 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.16_3549) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.850 | 1.870 |
| High resolution limit [Å] | 1.760 | 1.760 |
| Number of reflections | 55465 | 8761 |
| <I/σ(I)> | 16.9 | 1.5 |
| Completeness [%] | 99.7 | 99.3 |
| Redundancy | 10.9 | 10.4 |
| CC(1/2) | 0.999 | 0.607 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 283.15 | 0.1 M TRIS, pH 8.5, 4% PEG 6000 |
