5G55
3-Quinoline Carboxamides inhibitors of Pi3K
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF |
| Synchrotron site | ESRF |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | ADSC CCD |
| Wavelength(s) | 0.9330 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 140.077, 67.182, 104.559 |
| Unit cell angles | 90.00, 96.65, 90.00 |
Refinement procedure
| Resolution | 72.000 - 2.450 |
| Rwork | 0.254 |
| R-free | 0.32206 |
| Structure solution method | OTHER |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.680 |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 70.000 |
| High resolution limit [Å] | 2.450 |
| Rmerge | 0.060 |
| Number of reflections | 32672 |
| Completeness [%] | 96.0 |
| Redundancy | 4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
