4TN6
CK1d in complex with inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-BM |
Synchrotron site | APS |
Beamline | 17-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-03-20 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.0 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 56.487, 115.336, 61.533 |
Unit cell angles | 90.00, 109.27, 90.00 |
Refinement procedure
Resolution | 29.630 - 2.410 |
R-factor | 0.1897 |
Rwork | 0.187 |
R-free | 0.23870 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | PDB 4KB8 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.090 |
Refinement software | BUSTER (2.11.5) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 33.000 | 2.490 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.100 | 0.538 |
Number of reflections | 28261 | |
<I/σ(I)> | 13.76 | 1.57 |
Completeness [%] | 98.3 | 85.9 |
Redundancy | 3.36 | 3.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 296 | 0.1M NaAcetate, pH=5.6, 0.2 M Li2SO4, 14-17.5% PEG3350, 3-5.5% 1,3 propandiol |