6SS7
Human Leukocyte Antigen Class I A02 Carrying LLWAGPMAV
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-07-14 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97625 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 117.560, 169.250, 49.070 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 84.620 - 2.500 |
| R-factor | 0.2295 |
| Rwork | 0.226 |
| R-free | 0.30440 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.888 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 84.620 | 2.420 |
| High resolution limit [Å] | 2.360 | 2.360 |
| Rmerge | 0.248 | 1.713 |
| Rmeas | 0.288 | 1.982 |
| Rpim | 0.145 | 0.988 |
| Number of reflections | 41105 | 2956 |
| <I/σ(I)> | 6.3 | 1.2 |
| Completeness [%] | 99.6 | 99.4 |
| Redundancy | 7.2 | 7.6 |
| CC(1/2) | 0.990 | 0.484 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.1 M Sodium Cacodylate pH 6.0, 0.2 M Ammonium Sulphate, 25% PEG 4000. A2/LLW-7I crystals were grown in 0.1 M Mes pH 7.0, 0.2 M Ammonium Sulphate, 25% PEG 8000 |
