6V8L
Crystal structure of Ara h 8.0201
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-ID |
| Synchrotron site | APS |
| Beamline | 22-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-06-29 |
| Detector | RAYONIX MX300-HS |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 39.913, 110.565, 65.772 |
| Unit cell angles | 90.00, 96.58, 90.00 |
Refinement procedure
| Resolution | 24.100 - 1.950 |
| R-factor | 0.2201 |
| Rwork | 0.218 |
| R-free | 0.25790 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6v8h |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.520 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 1.980 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Rmerge | 0.039 | 0.352 |
| Rmeas | 0.047 | 0.424 |
| Rpim | 0.026 | 0.234 |
| Number of reflections | 40882 | 2067 |
| <I/σ(I)> | 35.4 | 3.7 |
| Completeness [%] | 98.9 | 100 |
| Redundancy | 3.2 | 3.3 |
| CC(1/2) | 0.866 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7 | 298 | 0.1M HEPES, 2.4M Ammonium Sulfate, pH 7.0 |
