6CN6
RORC2 LBD complexed with compound 34
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-03-24 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.0 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 90.840, 90.840, 138.252 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 78.670 - 2.450 |
R-factor | 0.1917 |
Rwork | 0.189 |
R-free | 0.24070 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.010 |
RMSD bond angle | 1.020 |
Data reduction software | XDS |
Data scaling software | autoPROC |
Phasing software | REFMAC |
Refinement software | BUSTER (2.11.6) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 138.250 | 3.000 |
High resolution limit [Å] | 2.450 | 2.450 |
Number of reflections | 243204 | |
<I/σ(I)> | 20.5 | |
Completeness [%] | 100.0 | |
Redundancy | 18.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 8.7 | 298 | 0.1 M Tris pH 8.7, 27% ethanol |