6GHN
HLA-E*01:03 in complex with the Mtb44 peptide variant: Mtb44*P9-Phe.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-07-02 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.9795 |
| Spacegroup name | P 1 |
| Unit cell lengths | 37.453, 64.681, 97.308 |
| Unit cell angles | 107.03, 93.89, 106.84 |
Refinement procedure
| Resolution | 58.498 - 2.542 |
| R-factor | 0.2205 |
| Rwork | 0.218 |
| R-free | 0.26420 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6gh1 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.837 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 58.500 | 2.590 |
| High resolution limit [Å] | 2.540 | 2.540 |
| Rmerge | 0.210 | |
| Number of reflections | 26488 | 1053 |
| <I/σ(I)> | 5.2 | |
| Completeness [%] | 97.7 | 77.5 |
| Redundancy | 4.9 | |
| CC(1/2) | 0.980 | 0.570 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293.5 | 2.4 M Ammonium Sulphate, 0.1 M HEPES, pH 7 |
