6MSS
Diversity in the type II Natural Killer T cell receptor repertoire and antigen specificity leads to differing CD1d docking strategies
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 | 2014-06-20 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9537 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 42.580, 141.260, 170.670 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 65.260 - 3.000 |
| R-factor | 0.186 |
| Rwork | 0.183 |
| R-free | 0.24200 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.970 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.10.3) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 73.040 | 3.150 |
| High resolution limit [Å] | 3.000 | 3.000 |
| Rpim | 0.121 | 0.324 |
| Number of reflections | 21533 | 3053 |
| <I/σ(I)> | 5.3 | |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 5.9 | 2.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.8 | 293 | 15-25% PEG 1500 10% succinate phosphate glycine pH 6.8 |
