2A5U
Crystal Structure of human PI3Kgamma complexed with AS605240
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-05-05 |
Detector | MARRESEARCH |
Wavelength(s) | 1.0716 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 140.446, 67.406, 105.971 |
Unit cell angles | 90.00, 96.35, 90.00 |
Refinement procedure
Resolution | 19.580 - 2.700 |
R-factor | 0.285 |
Rwork | 0.279 |
R-free | 0.35100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1e8y |
RMSD bond length | 0.007 |
RMSD bond angle | 1.200 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | AMoRE |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 105.410 | 2.850 |
High resolution limit [Å] | 2.700 | 2.700 |
Rmerge | 0.072 | 0.266 |
Number of reflections | 28933 | |
<I/σ(I)> | 7 | 2.3 |
Completeness [%] | 96.5 | 98.5 |
Redundancy | 4.8 | 4.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.2 | 300 | 22% PEG 4K, 100mM Tris-HCl, 200mM (NH4)2SO4, pH 7.2, VAPOR DIFFUSION, HANGING DROP, temperature 300K |