5YNX
Structure of house dust mite allergen Der f 21 in PEG400
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2014-07-18 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.5418 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 123.456, 27.714, 90.252 |
| Unit cell angles | 90.00, 125.84, 90.00 |
Refinement procedure
| Resolution | 19.600 - 1.490 |
| R-factor | 0.1417 |
| Rwork | 0.139 |
| R-free | 0.19830 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.851 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.600 | 1.520 |
| High resolution limit [Å] | 1.490 | 1.490 |
| Rmerge | 0.026 | 0.258 |
| Rpim | 0.016 | 0.187 |
| Number of reflections | 41016 | 1937 |
| <I/σ(I)> | 22.6 | |
| Completeness [%] | 99.5 | 95.6 |
| Redundancy | 3.3 | 3.1 |
| CC(1/2) | 1.000 | 0.977 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | 0.19M Tris pH 8.0, 32% PEG 400 |
