6GH1
HLA-E*01:03 in complex with Mtb44
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 | 2016-07-15 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.9686 |
| Spacegroup name | P 1 |
| Unit cell lengths | 48.380, 76.600, 111.150 |
| Unit cell angles | 99.33, 99.56, 93.66 |
Refinement procedure
| Resolution | 48.021 - 2.100 |
| R-factor | 0.1929 |
| Rwork | 0.191 |
| R-free | 0.22880 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1mhe |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.541 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 53.910 | 2.130 |
| High resolution limit [Å] | 2.090 | 2.090 |
| Rmerge | 0.085 | 0.472 |
| Number of reflections | 81176 | |
| <I/σ(I)> | 2.8 | 1.1 |
| Completeness [%] | 89.1 | 47 |
| Redundancy | 1.7 | 1.5 |
| CC(1/2) | 0.985 | 0.668 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6 | 293.5 | 2.4 M Ammonium Sulphate, 0.1 M MES, pH 6 |
