5WMR
Crystal Structure of HLA-B8 in complex with QIK, a CMV peptide
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 | 2015-02-19 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.954 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 50.637, 81.520, 110.900 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 33.990 - 1.580 |
R-factor | 0.1925 |
Rwork | 0.191 |
R-free | 0.22760 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1m05 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.080 |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | BUSTER |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 65.683 | 1.610 |
High resolution limit [Å] | 1.580 | 1.580 |
Rpim | 0.033 | 0.344 |
Number of reflections | 63214 | 2905 |
<I/σ(I)> | 17.2 | |
Completeness [%] | 99.8 | |
Redundancy | 7.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | 18-24%PEG4000, 0.2 NH4 Acetate, 0.1M Na-cacodylate pH 6.5 |