9HI7
Structure of MC.7.G5 T cell receptor in complex with MR1 R9H
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 | 2022-02-14 |
| Detector | DECTRIS EIGER2 XE 16M |
| Wavelength(s) | 0.9795 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 72.030, 113.202, 130.363 |
| Unit cell angles | 90.00, 90.73, 90.00 |
Refinement procedure
| Resolution | 130.350 - 2.810 |
| R-factor | 0.23864 |
| Rwork | 0.236 |
| R-free | 0.29576 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.791 |
| Data reduction software | autoPROC |
| Data scaling software | autoPROC |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 130.350 | 2.879 |
| High resolution limit [Å] | 2.810 | 2.810 |
| Rmerge | 0.207 | 3.030 |
| Rmeas | 0.225 | 3.287 |
| Rpim | 0.085 | 1.264 |
| Number of reflections | 51269 | 2548 |
| <I/σ(I)> | 7.1 | 0.6 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 6.8 | 6.7 |
| CC(1/2) | 0.995 | 0.382 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 50 mM HEPES pH 7.0, 250 mM NaCl and 11% PEG 8000 |
