4M9W
Crystal Structure of Ara h 8 with MES bound
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-06-22 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.98 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 40.183, 87.488, 42.290 |
| Unit cell angles | 90.00, 95.84, 90.00 |
Refinement procedure
| Resolution | 40.010 - 1.950 |
| R-factor | 0.20758 |
| Rwork | 0.205 |
| R-free | 0.24796 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 4m9b |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.781 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | HKL-3000 |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.980 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Rmerge | 0.052 | 0.364 |
| Number of reflections | 21429 | |
| <I/σ(I)> | 35.9 | 2.9 |
| Completeness [%] | 100.0 | 99.6 |
| Redundancy | 4.1 | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 0.1 M MES (6.5), 25% PEG 2000MME, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
