Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-E SUPERBRIGHT |
| Temperature [K] | 95 |
| Detector technology | IMAGE PLATE |
| Collection date | 2005-05-27 |
| Detector | RIGAKU RAXIS HTC |
| Wavelength(s) | 1.54182 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 85.440, 88.840, 105.390 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 67.420 - 2.100 |
| R-factor | 0.2226 |
| Rwork | 0.220 |
| R-free | 0.26480 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.208 |
| Data reduction software | CrystalClear |
| Data scaling software | CrystalClear |
| Phasing software | BUSTER-TNT (1.3.1) |
| Refinement software | BUSTER-TNT (1.3.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 100.000 | 2.180 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.044 | 0.469 |
| Number of reflections | 46716 | |
| <I/σ(I)> | 11.6 | 2.2 |
| Completeness [%] | 98.2 | 98.1 |
| Redundancy | 3.68 | 3.66 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7 | 277 | 10-30% MPD OR ISOPROPANOL, 100 mM IMIDAZOLE, 1 mM SR12813, pH 7, VAPOR DIFFUSION, temperature 277K |
