8GON
SARS-CoV-2 specific private TCR RLQ7 in complex with RLQ-T1006I-HLA-A2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-B |
Synchrotron site | APS |
Beamline | 23-ID-B |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-10-04 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.9793 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 147.366, 147.366, 178.819 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 48.237 - 2.601 |
R-factor | 0.2009 |
Rwork | 0.198 |
R-free | 0.25270 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 8gom |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX (1.16_3549) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.240 | 2.694 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.113 | |
Number of reflections | 35792 | 3505 |
<I/σ(I)> | 22 | |
Completeness [%] | 99.9 | |
Redundancy | 25.1 | |
CC(1/2) | 0.994 | 0.942 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 0.1 M Tris-HCl pH 8.5, 15% PEG 6000 |