Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PETRA III, DESY BEAMLINE P11 |
| Synchrotron site | PETRA III, DESY |
| Beamline | P11 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-05-18 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.992 |
| Spacegroup name | P 2 21 21 |
| Unit cell lengths | 31.300, 66.530, 89.500 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 53.390 - 1.590 |
| R-factor | 0.14219 |
| Rwork | 0.141 |
| R-free | 0.16534 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2fav |
| RMSD bond length | 0.027 |
| RMSD bond angle | 2.487 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 53.390 | 1.680 |
| High resolution limit [Å] | 1.590 | 1.590 |
| Rmerge | 0.047 | 0.211 |
| Number of reflections | 24489 | |
| <I/σ(I)> | 27.6 | 9.2 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 10.9 | 10.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.1 M Bis-Tris propane pH 7.0, 1.3 M sodium citrate tribasic dihydrate. |
