7T8P
CRYSTAL STRUCTURE OF T151V CAO1
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 | 2021-04-07 |
Detector | DECTRIS EIGER2 X 16M |
Wavelength(s) | 0.979110 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 101.507, 101.507, 450.646 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 48.080 - 1.900 |
R-factor | 0.1861 |
Rwork | 0.185 |
R-free | 0.20410 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 5u8x |
RMSD bond length | 0.005 |
RMSD bond angle | 1.305 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | REFMAC |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.020 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.088 | 1.542 |
Number of reflections | 210666 | 32972 |
<I/σ(I)> | 11.2 | 0.91 |
Completeness [%] | 99.0 | 97 |
Redundancy | 4 | 3.9 |
CC(1/2) | 0.998 | 0.343 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 295 | 0.05 M HEPES pH 7 36% sodium polyacrylate 2100 |