Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-09-11 |
Detector | DECTRIS EIGER2 X 16M |
Wavelength(s) | 0.7 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 104.578, 104.578, 322.501 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 47.020 - 2.850 |
R-factor | 0.1948 |
Rwork | 0.193 |
R-free | 0.24000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4ey4 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.062 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((1.17.1_3660: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.020 | 2.940 |
High resolution limit [Å] | 2.850 | 2.850 |
Rmerge | 0.150 | 0.566 |
Number of reflections | 48576 | 4372 |
<I/σ(I)> | 2.6 | |
Completeness [%] | 99.8 | |
Redundancy | 4.2 | |
CC(1/2) | 0.988 | 0.840 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 9 | 293.15 | 100 mM Tris HCl buffer pH 9.0, 20 % PEG 3350, 200 mM KNO3 |