3TN0
Structure of mouse Va14Vb8.2NKT TCR-mouse CD1d-a-C-Galactosylceramide 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 | 2010-02-18 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.95453 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 59.171, 86.368, 236.403 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.770 - 3.200 |
R-factor | 0.2286 |
Rwork | 0.225 |
R-free | 0.28870 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3he6 |
RMSD bond length | 0.006 |
RMSD bond angle | 1.005 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.370 |
High resolution limit [Å] | 3.200 | 3.200 |
Rmerge | 0.272 | 1.080 |
Number of reflections | 20725 | |
<I/σ(I)> | 7.2 | 2.2 |
Completeness [%] | 100.0 | 100 |
Redundancy | 8.1 | 8.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 295 | 15-17% PEG 10K, 0.1M ammonium acetat, 0.1M BisTris pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 295K |