5C0F
HLA-A02 carrying RQWGPDPAAV
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I02 |
Synchrotron site | Diamond |
Beamline | I02 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2011-01-29 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9763 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 56.360, 79.780, 56.970 |
Unit cell angles | 90.00, 115.70, 90.00 |
Refinement procedure
Resolution | 42.840 - 1.463 |
R-factor | 0.1536 |
Rwork | 0.152 |
R-free | 0.18080 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3utq |
RMSD bond length | 0.019 |
RMSD bond angle | 2.086 |
Data reduction software | XDS |
Data scaling software | SCALA (3.3.15) |
Phasing software | PHASER (2.1.4) |
Refinement software | REFMAC (5.8.0023) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 42.841 | 42.841 | 1.500 |
High resolution limit [Å] | 1.460 | 6.540 | 1.460 |
Rmerge | 0.020 | 0.545 | |
Rmeas | 0.069 | ||
Rpim | 0.034 | 0.014 | 0.362 |
Total number of observations | 313592 | 3473 | 23295 |
Number of reflections | 77814 | ||
<I/σ(I)> | 14.7 | 44.4 | 2.3 |
Completeness [%] | 99.4 | 98.3 | 100 |
Redundancy | 4 | 3.9 | 4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.1M TRIS, pH 8, 20% PEG 8000, 15% glycerol |