4L8S
Crystal structure of a human Valpha7.2/Vbeta13.3 MAIT TCR in complex with bovine MR1
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 | CCD |
Collection date | 2013-04-20 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1.03316 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 83.068, 87.285, 155.817 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 44.039 - 2.900 |
R-factor | 0.2305 |
Rwork | 0.228 |
R-free | 0.27760 |
RMSD bond length | 0.003 |
RMSD bond angle | 0.750 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.950 |
High resolution limit [Å] | 2.900 | 2.900 |
Number of reflections | 27400 | |
<I/σ(I)> | 20.9 | 2.9 |
Completeness [%] | 95.8 | 97.2 |
Redundancy | 6.3 | 6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 291 | 0.1 M Hepes, 1.7 M Ammonium Sulfate, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 291.0K |