Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-10-10 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97949 |
| Spacegroup name | P 43 |
| Unit cell lengths | 101.878, 101.878, 164.546 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 64.008 - 1.900 |
| Rwork | 0.178 |
| R-free | 0.20770 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1qgd |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.605 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MoRDa |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 86.620 | 1.930 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmeas | 0.053 | 4.245 |
| Number of reflections | 131289 | 6524 |
| <I/σ(I)> | 13.1 | |
| Completeness [%] | 99.8 | |
| Redundancy | 5.2 | |
| CC(1/2) | 0.999 | 0.339 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 291 | ammonium sulphate |
