4PRH
Crystal structure of TK3 TCR-HLA-B*35:08-HPVG-D5 complex
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 | 2012-11-13 |
Detector | ADSC QUANTUM 315r |
Spacegroup name | P 1 |
Unit cell lengths | 44.835, 62.081, 98.334 |
Unit cell angles | 92.70, 101.92, 108.21 |
Refinement procedure
Resolution | 35.680 - 2.500 |
R-factor | 0.2142 |
Rwork | 0.212 |
R-free | 0.25260 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2fyy |
RMSD bond length | 0.009 |
RMSD bond angle | 1.170 |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.600 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.075 | 0.445 |
Number of reflections | 32833 | |
<I/σ(I)> | 11.79 | 3.27 |
Completeness [%] | 96.9 | 98.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.6 | 298 | 18% PEG 3350, 0.2M LiSO4 and 0.1M Na-Citrate pH 5.6, vapor diffusion, temperature 298K |