4AEN
HLA-DR1 with covalently linked CLIP106-120 in reversed orientation
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-02-22 |
Detector | MARMOSAIC 225 mm CCD |
Spacegroup name | C 2 2 2 |
Unit cell lengths | 66.196, 145.111, 108.777 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 34.414 - 2.200 |
R-factor | 0.1853 |
Rwork | 0.183 |
R-free | 0.22070 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3pdo |
RMSD bond length | 0.007 |
RMSD bond angle | 1.053 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 34.420 | 2.260 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.080 | 0.560 |
Number of reflections | 27008 | |
<I/σ(I)> | 15.8 | 2.9 |
Completeness [%] | 99.9 | 100 |
Redundancy | 4.5 | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 2 M (NH4)2SO4, 0.1 M TRIS, PH 8.0 |