Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL19U1 |
Synchrotron site | SSRF |
Beamline | BL19U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-09-26 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.979 |
Spacegroup name | P 31 |
Unit cell lengths | 185.401, 185.401, 382.849 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 47.560 - 3.700 |
R-factor | 0.2959 |
Rwork | 0.295 |
R-free | 0.34090 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7cr6 |
RMSD bond length | 0.004 |
RMSD bond angle | 0.949 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX (1.15.2_3472) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.920 |
High resolution limit [Å] | 3.690 | 3.690 |
Number of reflections | 157305 | 25305 |
<I/σ(I)> | 12.68 | |
Completeness [%] | 99.9 | |
Redundancy | 10.5 | |
CC(1/2) | 0.998 | 0.838 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 30% MPD, 0.1 M imidazole pH 6.5, 0.2 M (NH4)2SO4, 10% (w/v) PEG 3350 |