3TA3
Structure of the mouse CD1d-Glc-DAG-s2-iNKT TCR complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL7-1 |
| Synchrotron site | SSRL |
| Beamline | BL7-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-06-03 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9795 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 78.150, 190.720, 150.880 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 44.490 - 2.700 |
| R-factor | 0.2077 |
| Rwork | 0.205 |
| R-free | 0.25646 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3o8x |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.191 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.500 | 2.850 |
| High resolution limit [Å] | 2.700 | 2.700 |
| Rmerge | 0.135 | 0.530 |
| Number of reflections | 31376 | |
| <I/σ(I)> | 7.1 | 2.4 |
| Completeness [%] | 99.8 | 99.9 |
| Redundancy | 4 | 4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5 | 295 | 17% PEG 3350, 8% tacsimate pH 5.0, VAPOR DIFFUSION, SITTING DROP, temperature 295K |
