Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-02-20 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.2816, 1.2856, 0.9537 |
| Spacegroup name | I 21 21 21 |
| Unit cell lengths | 34.830, 61.290, 78.670 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 39.335 - 1.800 |
| R-factor | 0.2166 |
| Rwork | 0.216 |
| R-free | 0.23550 |
| Structure solution method | MAD |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.844 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA (3.3.22) |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.10_2155) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 39.340 | 5.690 | 1.900 |
| High resolution limit [Å] | 1.800 | 4.030 | 1.800 |
| Rmerge | 0.054 | 1.074 | |
| Number of reflections | 8140 | ||
| <I/σ(I)> | 13.8 | 11.2 | 0.6 |
| Completeness [%] | 100.0 | 100 | 100 |
| Redundancy | 9.1 | 8.1 | 9.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291 | 8% (w/v) PEG 4000 (polyethylene glycol 4000), 16% (v/v) glycerol, 0.02 M of each carboxylic acid (sodium formate, ammonium acetate, trisodium citrate and sodium potassium L-tartrate) and 0.1 M MES/Imidazole pH 6.5 |
