7T8Q
CRYSTAL STRUCTURE OF T151G CAO1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-E |
Synchrotron site | APS |
Beamline | 24-ID-E |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-06-17 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.979180 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 100.632, 100.632, 447.661 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 49.090 - 2.150 |
R-factor | 0.1911 |
Rwork | 0.190 |
R-free | 0.21110 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 5u8x |
RMSD bond length | 0.003 |
RMSD bond angle | 1.197 |
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 | 2.280 |
High resolution limit [Å] | 2.150 | 2.150 |
Rmerge | 0.124 | 1.475 |
Number of reflections | 142491 | 22485 |
<I/σ(I)> | 13.8 | 1.1 |
Completeness [%] | 99.0 | |
Redundancy | 5.1 | |
CC(1/2) | 0.997 | 0.429 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 295 | 0.1 M HEPES-NaOH pH 7 42% sodium polyacrylate 2100 |