6FRR
Structural and immunological properties of the allergen Art v 3
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-07-24 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.8856 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 60.398, 60.398, 91.460 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 45.405 - 1.948 |
| R-factor | 0.1956 |
| Rwork | 0.193 |
| R-free | 0.24940 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2alg |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.828 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | REFMAC |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 52.310 | 2.050 |
| High resolution limit [Å] | 1.948 | 1.950 |
| Rmerge | 0.083 | 0.310 |
| Number of reflections | 14608 | 2087 |
| <I/σ(I)> | 17.2 | 6.7 |
| Completeness [%] | 99.7 | 99.9 |
| Redundancy | 6.4 | 10 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | 3.2 M ammonium sulphate, 0.1 M HEPES, pH 7.0 |
