4QDV
Dcps in complex with covalent ligand
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-10-10 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 101.090, 105.510, 140.000 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 84.260 - 2.800 |
R-factor | 0.2078 |
Rwork | 0.205 |
R-free | 0.24990 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.010 |
RMSD bond angle | 1.190 |
Data scaling software | autoPROC |
Phasing software | BUSTER |
Refinement software | BUSTER |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 84.260 | 3.130 |
High resolution limit [Å] | 2.800 | 2.800 |
Rmerge | 0.170 | 0.910 |
Number of reflections | 35486 | |
<I/σ(I)> | 12 | 4.1 |
Completeness [%] | 95.3 | 97.3 |
Redundancy | 4.7 | 4.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 22-25% PEG3350, 50 mM sodium chloride, 26% glycerol, crystals soaked in 1 mM compound overnight, VAPOR DIFFUSION, HANGING DROP |