Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL02U1 |
Synchrotron site | SSRF |
Beamline | BL02U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-05-26 |
Detector | DECTRIS EIGER2 S 9M |
Wavelength(s) | 0.97918 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 86.450, 86.450, 351.040 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 54.500 - 2.430 |
R-factor | 0.19707 |
Rwork | 0.194 |
R-free | 0.24616 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 1.422 |
Data reduction software | Aimless |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 54.500 | 2.500 |
High resolution limit [Å] | 2.430 | 2.430 |
Rmerge | 0.141 | 1.953 |
Number of reflections | 51611 | 4368 |
<I/σ(I)> | 19.3 | 2 |
Completeness [%] | 100.0 | 100 |
Redundancy | 25.2 | 22.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | 0.15 M Ammonium sulfate, 0.1 M TRIS pH 8, 15% w/v PEG 4000 |