3FC2
PLK1 in complex with BI6727
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 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 1.000 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 66.616, 66.616, 153.969 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.180 - 2.450 |
R-factor | 0.184 |
Rwork | 0.183 |
R-free | 0.22600 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.222 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 2.580 | |
High resolution limit [Å] | 2.450 | 2.450 |
Rmerge | 0.094 | 0.568 |
Number of reflections | 14942 | 2123 |
<I/σ(I)> | 5.4 | |
Completeness [%] | 98.3 | 98.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 277 | VAPOR DIFFUSION, HANGING DROP, temperature 277K |