6MTL
Crystal Structure of HLA-B*44:05 in complex with NP338 influenza 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 | 2013-08-16 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.954 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 82.188, 110.524, 50.901 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 13.610 - 1.350 |
R-factor | 0.193 |
Rwork | 0.192 |
R-free | 0.21000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3gso |
RMSD bond length | 0.010 |
RMSD bond angle | 1.030 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | BUSTER |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 65.952 | 1.420 |
High resolution limit [Å] | 1.350 | 1.350 |
Rpim | 0.038 | 0.304 |
Number of reflections | 101079 | 13835 |
<I/σ(I)> | 10.8 | |
Completeness [%] | 98.8 | 93.9 |
Redundancy | 6.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | 20% PEG6000, 0.2M NaCl, 0.1M Na citrate pH 6.5 |