5JTB
Crystal structure of the chimeric protein of A2aAR-BRIL with bound iodide ions
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-12-13 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 1.85 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 39.648, 179.793, 139.810 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 89.900 - 2.800 |
R-factor | 0.2377 |
Rwork | 0.234 |
R-free | 0.29444 |
Structure solution method | SAD |
RMSD bond length | 0.010 |
RMSD bond angle | 1.339 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | SHELXCD |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 100.000 | 2.900 |
High resolution limit [Å] | 2.800 | 2.800 |
Rmerge | 0.185 | 0.847 |
Number of reflections | 23712 | |
<I/σ(I)> | 8.83 | 2.1 |
Completeness [%] | 1.0 | 98.2 |
Redundancy | 6.87 | 6.91 |
CC(1/2) | 0.997 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | LIPIDIC CUBIC PHASE | 293 | in meso lipidic cubic phase crystallization |