5D7I
Structure of human MR1-Ac-6-FP in complex with human MAIT M33.64 TCR
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-03-22 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.954 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 214.300, 69.660, 141.190 |
| Unit cell angles | 90.00, 103.99, 90.00 |
Refinement procedure
| Resolution | 51.740 - 2.000 |
| R-factor | 0.1798 |
| Rwork | 0.178 |
| R-free | 0.22010 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4l4t |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.086 |
| Data reduction software | iMOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.9_1692)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 51.740 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Number of reflections | 133791 | |
| <I/σ(I)> | 8.7 | 1.2 |
| Completeness [%] | 98.1 | 97 |
| Redundancy | 3.7 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 294 | BTP, PEG 3350, NaAc |
