5XF3
Nucleosome core particle with an adduct of a binuclear RAPTA (Ru-arene-phosphaadamantane) compound having a 1,2-diphenylethylenediamine linker (R,R-configuration)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-10-09 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 1.5 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 108.190, 109.400, 174.820 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 52.748 - 2.600 |
R-factor | 0.23534 |
Rwork | 0.235 |
R-free | 0.27017 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3mnn |
RMSD bond length | 0.009 |
RMSD bond angle | 1.452 |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 58.270 | 2.670 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.505 | |
Number of reflections | 64455 | |
<I/σ(I)> | 15 | |
Completeness [%] | 99.9 | 99.6 |
Redundancy | 5.8 | 5.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 291 | 35-55 mM MnCl2, 25-49 mM KCl, 20 mM K-Cacodylate pH 6.0 |