4G8E
Crystal Structure of clone18 TCR
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-02-16 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.956 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 46.420, 84.090, 58.280 |
Unit cell angles | 90.00, 111.88, 90.00 |
Refinement procedure
Resolution | 45.480 - 2.200 |
R-factor | 0.2439 |
Rwork | 0.241 |
R-free | 0.29350 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2nw2 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.400 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | BUSTER-TNT |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 100.000 | 2.400 | |
High resolution limit [Å] | 2.200 | 10.000 | 2.200 |
Rmerge | 0.048 | 0.022 | 0.235 |
Number of reflections | 233 | 4208 | |
<I/σ(I)> | 18.57 | 41.18 | 5.49 |
Completeness [%] | 95.8 | 95.1 | 86.8 |
Redundancy | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | 25% PEG1500, 10% Proprionate-cacodylate-bis tris propane pH 7, vapor diffusion, hanging drop, temperature 298K |