Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX IV BEAMLINE BioMAX |
Synchrotron site | MAX IV |
Beamline | BioMAX |
Temperature [K] | 210 |
Detector technology | PIXEL |
Collection date | 2018-11-03 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.91840 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 130.886, 130.886, 61.026 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 65.529 - 2.100 |
Rwork | 0.199 |
R-free | 0.23130 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5ocx |
RMSD bond length | 0.011 |
RMSD bond angle | 1.757 |
Data reduction software | Aimless (0.7.4) |
Data scaling software | XDS |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 65.529 | 65.440 | 2.160 |
High resolution limit [Å] | 2.100 | 8.910 | 2.100 |
Rmerge | 0.155 | 0.055 | 1.463 |
Rmeas | 0.164 | 0.058 | 1.554 |
Rpim | 0.055 | 0.020 | 0.522 |
Number of reflections | 31556 | 501 | 2524 |
<I/σ(I)> | 10.4 | ||
Completeness [%] | 100.0 | ||
Redundancy | 16.4 | 13.3 | 16.8 |
CC(1/2) | 0.998 | 0.999 | 0.855 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 20mM Tris pH 7.4, 50mM NaCl, 0.2M Potassium thiocyanate, 2.2M Ammonium sulfate) |