5DNN

Nucleosome core particle containing adducts of gold(I)-triethylphosphane and ruthenium(II)-toluene PTA complexes

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	90
Detector technology	PIXEL
Collection date	2013-09-09
Detector	PSI PILATUS 6M
Wavelength(s)	1.5
Spacegroup name	P 21 21 21
Unit cell lengths	106.726, 109.948, 182.041
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.870 - 2.800
R-factor	0.21574
Rwork	0.215
R-free	0.23648
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5dnm
RMSD bond length	0.007
RMSD bond angle	1.459
Refinement software	REFMAC (5.6.0117)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.870	2.950
High resolution limit [Å]	2.800	2.800
Rmerge	0.037	0.433
Number of reflections	51082
<I/σ(I)>	23.2	1.6
Completeness [%]	95.8	76.6
Redundancy	5	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	291	40 mM MnCl2, 30 mM KCl, 20 mM K-Cacodylate