Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-03-10 |
| Detector | DECTRIS EIGER X 4M |
| Wavelength(s) | 0.97372 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 89.690, 103.570, 155.950 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 46.503 - 1.780 |
| Rwork | 0.172 |
| R-free | 0.20210 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5ncc |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.661 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0257) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 86.000 | 86.000 | 1.900 |
| High resolution limit [Å] | 1.780 | 5.000 | 1.780 |
| Rmerge | 0.086 | 0.026 | 1.132 |
| Rmeas | 0.096 | 0.029 | 1.269 |
| Number of reflections | 69240 | 3293 | 12174 |
| <I/σ(I)> | 11.02 | 39.53 | 1.03 |
| Completeness [%] | 99.3 | 98.4 | 99.4 |
| Redundancy | 4.727 | 4.565 | 4.838 |
| CC(1/2) | 0.998 | 0.999 | 0.512 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 281 | PEG 4000 25-40%, Na citrate 100 mM, spermidine 10mM |
