9GG9
HUMAN PI3KGAMMA IN COMPLEX WITH ISOCUMARIN INHIBITOR 11
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-12-19 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.99988 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 144.651, 68.816, 106.754 |
| Unit cell angles | 90.00, 95.36, 90.00 |
Refinement procedure
| Resolution | 106.290 - 3.000 |
| R-factor | 0.21511 |
| Rwork | 0.213 |
| R-free | 0.28529 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.097 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 106.290 | 3.250 |
| High resolution limit [Å] | 3.000 | 3.000 |
| Rmerge | 0.049 | 0.447 |
| Number of reflections | 20358 | 4340 |
| <I/σ(I)> | 19.45 | |
| Completeness [%] | 96.0 | |
| Redundancy | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 277 | PEG4000, (NH4)2SO4, TRIS |
