6PUC
Structure of human MAIT A-F7 TCR in complex with human MR1-5-OP-RU
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2017-06-23 |
| Detector | ADSC QUANTUM 210r |
| Wavelength(s) | 0.9537 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 217.967, 70.248, 143.634 |
| Unit cell angles | 90.00, 104.81, 90.00 |
Refinement procedure
| Resolution | 48.340 - 1.850 |
| R-factor | 0.1604 |
| Rwork | 0.159 |
| R-free | 0.17830 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4l4t |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.885 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.16_3549) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.340 | 1.880 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Rmerge | 0.067 | 0.791 |
| Number of reflections | 179134 | 8788 |
| <I/σ(I)> | 10.6 | 1.6 |
| Completeness [%] | 99.9 | 99.8 |
| Redundancy | 5 | 5 |
| CC(1/2) | 0.999 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 100 mM BTP (pH 6.0 - 6.5), 8-20% PEG3350 and 200 mM sodium acetate |
