Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | KURCHATOV SNC BEAMLINE K4.4 |
| Synchrotron site | KURCHATOV SNC |
| Beamline | K4.4 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-11-10 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.985 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 48.150, 81.540, 78.500 |
| Unit cell angles | 90.00, 104.75, 90.00 |
Refinement procedure
| Resolution | 75.910 - 1.750 |
| R-factor | 0.16193 |
| Rwork | 0.160 |
| R-free | 0.19510 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.810 |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 75.912 | 1.800 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmerge | 0.060 | 0.335 |
| Number of reflections | 52971 | |
| <I/σ(I)> | 11.27 | 2.61 |
| Completeness [%] | 89.4 | 77.6 |
| Redundancy | 2.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 0.01 M zinc acetate, 0.1M sodium cacodylate, 20% PEG 8000 |
