4AH2
HLA-DR1 with covalently linked CLIP106-120 in canonical 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 | 2011-01-13 |
| Detector | MARRESEARCH MX-225 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 57.644, 65.616, 131.331 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 32.833 - 2.360 |
| R-factor | 0.1939 |
| Rwork | 0.191 |
| R-free | 0.24020 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3pdo |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.019 |
| 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] | 32.840 | 2.420 |
| High resolution limit [Å] | 2.360 | 2.360 |
| Rmerge | 0.130 | 0.700 |
| Number of reflections | 21133 | |
| <I/σ(I)> | 10.7 | 2.4 |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 4.8 | 4.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | 0.2 M LICL, 20% (W/V) PEG6000, 0.1 M HEPES, PH 7.0 |
