5AWD
Crystal structure of human TLR8 in complex with N1-4-aminomethylbenzyl (IMDQ)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE AR-NE3A |
Synchrotron site | Photon Factory |
Beamline | AR-NE3A |
Temperature [K] | 95 |
Detector technology | CCD |
Collection date | 2013-11-09 |
Detector | ADSC QUANTUM 270 |
Wavelength(s) | 1.0000 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 135.660, 106.670, 72.160 |
Unit cell angles | 90.00, 106.24, 90.00 |
Refinement procedure
Resolution | 69.280 - 2.050 |
R-factor | 0.21733 |
Rwork | 0.215 |
R-free | 0.26901 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.608 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 82.526 |
High resolution limit [Å] | 2.050 |
Number of reflections | 61824 |
<I/σ(I)> | 9.6 |
Completeness [%] | 99.8 |
Redundancy | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | PEG3350, potassium formate, sodium citrate |