6FYR
X-RAY STRUCTURE OF CLK3-KD(GP-[275-632], NON-PHOS.)/Cpd-2 AT 1.42A
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-03-15 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.00003 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 108.932, 44.929, 83.635 |
Unit cell angles | 90.00, 114.82, 90.00 |
Refinement procedure
Resolution | 19.520 - 1.420 |
R-factor | 0.1767 |
Rwork | 0.176 |
R-free | 0.18920 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6fyp |
RMSD bond length | 0.007 |
RMSD bond angle | 1.078 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.520 | 1.460 |
High resolution limit [Å] | 1.420 | 1.420 |
Rmerge | 0.049 | 0.453 |
Rmeas | 0.058 | 0.537 |
Total number of observations | 230080 | |
Number of reflections | 68259 | |
<I/σ(I)> | 14.2 | 2.7 |
Completeness [%] | 98.0 | 96.2 |
Redundancy | 3.4 | 3.4 |
CC(1/2) | 0.999 | 0.820 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 298 | 25% PEG4000, 0.1M HEPES |