6BNL
Crystal structure of TCR-MHC-like molecule
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 | 2013-11-12 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9537 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 79.666, 150.318, 100.144 |
Unit cell angles | 90.00, 96.12, 90.00 |
Refinement procedure
Resolution | 38.070 - 2.600 |
R-factor | 0.183 |
Rwork | 0.181 |
R-free | 0.21400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3quz |
RMSD bond length | 0.010 |
RMSD bond angle | 1.120 |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | BUSTER (2.10.3) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 83.010 | 2.740 |
High resolution limit [Å] | 2.600 | 2.600 |
Rpim | 0.049 | 0.375 |
Number of reflections | 71925 | 10545 |
<I/σ(I)> | 21.2 | 2.3 |
Completeness [%] | 99.9 | 100 |
Redundancy | 4 | 4.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 277 | 18-20% PEG3350 8% tacsimate pH 5.0 0.5% dioxane |