Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE MASSIF-3 |
| Synchrotron site | ESRF |
| Beamline | MASSIF-3 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-11-17 |
| Detector | DECTRIS EIGER2 X 4M |
| Wavelength(s) | 0.9677 |
| Spacegroup name | P 31 1 2 |
| Unit cell lengths | 101.230, 101.230, 143.450 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 19.950 - 3.200 |
| R-factor | 0.2175 |
| Rwork | 0.217 |
| R-free | 0.23440 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4bv6 |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.559 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 3.280 |
| High resolution limit [Å] | 3.200 | 3.200 |
| Rmeas | 0.110 | 1.864 |
| Number of reflections | 26957 | 1997 |
| <I/σ(I)> | 13.58 | 1.24 |
| Completeness [%] | 99.3 | 99.7 |
| Redundancy | 5.5 | |
| CC(1/2) | 0.998 | 0.561 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.7 | 278 | 2 M (NH4)2SO4 0.5 g/ml PEG 400 100 mM MES-NaOH pH 6.7 100 mM CH3COOLi 5 mM TCEP |
