4ELA
Final Thaumatin Structure for Radiation Damage Experiment at 300 K
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CHESS BEAMLINE F1 |
| Synchrotron site | CHESS |
| Beamline | F1 |
| Temperature [K] | 300 |
| Detector technology | CCD |
| Collection date | 2010-06-22 |
| Detector | ADSC QUANTUM 270 |
| Wavelength(s) | .917 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 58.330, 58.330, 151.300 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 46.190 - 2.000 |
| R-factor | 0.1625 |
| Rwork | 0.161 |
| R-free | 0.19250 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.080 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | BUSTER (2.8.0) |
| Refinement software | BUSTER-TNT |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 99.000 | 99.000 | 1.570 |
| High resolution limit [Å] | 1.520 | 3.280 | 1.520 |
| Rmerge | 0.082 | 0.055 | 0.331 |
| Number of reflections | 17277 | ||
| <I/σ(I)> | 6.5 | ||
| Completeness [%] | 86.1 | 99.2 | 26.4 |
| Redundancy | 6.2 | 6.5 | 2.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.8 | 298 | sodium potassium tartrate, pH 6.8, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
