8BCY
HUMAN PI3KDELTA IN COMPLEX WITH COMPOUND 13
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 | 2015-06-23 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.00001 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 90.603, 108.809, 142.623 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 86.510 - 2.430 |
R-factor | 0.2243 |
Rwork | 0.224 |
R-free | 0.26340 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | NONE |
RMSD bond length | 0.009 |
RMSD bond angle | 1.251 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 86.510 | 2.680 |
High resolution limit [Å] | 2.430 | 2.430 |
Number of reflections | 51307 | 51307 |
<I/σ(I)> | 11.83 | |
Completeness [%] | 95.3 | 96.4 |
Redundancy | 4.9 | 4.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 16% PEG6000, 0.10 M KCL, 0.10 M MES |