3G04
Crystal structure of the TSH receptor in complex with a thyroid-stimulating autoantibody
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SRS BEAMLINE PX14.2 |
Synchrotron site | SRS |
Beamline | PX14.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-11-06 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.98 |
Spacegroup name | I 21 21 21 |
Unit cell lengths | 43.888, 175.784, 205.806 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 26.720 - 2.550 |
R-factor | 0.184 |
Rwork | 0.181 |
R-free | 0.24500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1xwd |
RMSD bond length | 0.009 |
RMSD bond angle | 1.236 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.610 |
High resolution limit [Å] | 2.550 | 2.550 |
Rmerge | 0.071 | 0.361 |
Number of reflections | 25731 | |
<I/σ(I)> | 10.5 | |
Completeness [%] | 96.1 | 99.2 |
Redundancy | 4.6 | 4.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 292 | 8% PEG 8000, 0.1M MES, 0.25M ZINC ACETATE, pH 6.00, VAPOR DIFFUSION, HANGING DROP, temperature 292K |