5T2D
mPI3Kd IN COMPLEX WITH 7j
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 | CCD |
Collection date | 2013-03-11 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.971 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 63.916, 142.418, 220.671 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 56.380 - 2.900 |
R-factor | 0.226 |
Rwork | 0.223 |
R-free | 0.28700 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.009 |
RMSD bond angle | 1.050 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | BUSTER (2.11.6) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 58.310 | 3.080 |
High resolution limit [Å] | 2.900 | 2.900 |
Rmerge | 0.135 | 0.711 |
Number of reflections | 22813 | |
<I/σ(I)> | 10.1 | 2.4 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 6.4 | 6.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 50% ethylene glycol/PEG 8000, 0.1 M carboxylic acids mix, 0.1 M Buffer system 2 pH 7.5 |