Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-06-11 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.978 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 116.527, 116.527, 130.712 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 43.570 - 2.470 |
R-factor | 0.18 |
Rwork | 0.178 |
R-free | 0.21510 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6pp9 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.047 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.571 | 2.560 |
High resolution limit [Å] | 2.470 | 2.470 |
Rmerge | 0.179 | |
Rmeas | 0.184 | |
Rpim | 0.041 | 0.459 |
Number of reflections | 37262 | 3669 |
<I/σ(I)> | 14.8 | 2 |
Completeness [%] | 99.9 | |
Redundancy | 19.8 | |
CC(1/2) | 1.000 | 0.717 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.4 | 293 | 100 mM Bis-Tris pH 6.4, 200 mM Ammonium Sulfate, and 22% PEG3350 |