6E6Z
Structure of Wild Type Human Transthyretin in Complex with Tafamidis
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 | 2018-03-23 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.9792 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 41.240, 84.260, 63.430 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 63.430 - 1.750 |
R-factor | 0.195 |
Rwork | 0.192 |
R-free | 0.22300 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.050 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Refinement software | BUSTER (2.10.3) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 63.430 | 63.430 | 1.790 |
High resolution limit [Å] | 1.750 | 7.820 | 1.750 |
Rmerge | 0.055 | 0.041 | 0.714 |
Rmeas | 0.057 | 0.043 | 0.744 |
Number of reflections | 23032 | 312 | 1681 |
<I/σ(I)> | 24.57 | 52.9 | 3.64 |
Completeness [%] | 99.8 | 100 | 98.5 |
Redundancy | 12.816 | 11.417 | 12.434 |
CC(1/2) | 0.999 | 0.999 | 0.950 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 298 | 20% (W/V) PEG-1000, 0.1M Imidazole, 0.2M Calcium Acetate |