5IWJ

LAmbda-[Ru(TAP)2(dppz)]2+ bound to d(CCGGGCCCGG

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I02
Synchrotron site	Diamond
Beamline	I02
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-12-08
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.97949
Spacegroup name	P 43 21 2
Unit cell lengths	46.783, 46.783, 34.948
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.000 - 1.880
R-factor	0.21403
Rwork	0.210
R-free	0.27716
Structure solution method	SAD
RMSD bond length	0.010
RMSD bond angle	2.323
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	SHELXDE
Refinement software	REFMAC (5.8.0135)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	28.000	1.930
High resolution limit [Å]	1.880	1.880
Rmerge	0.040	0.939
Number of reflections	3455
<I/σ(I)>	23.2	2.7
Completeness [%]	100.0	100
Redundancy	11.9	12.5
CC(1/2)	0.999

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	1uL 2mM ss oligonucleotide, 1uL 3mM rac-RuTAP2dppz, 6uL of a solution containing 20mM BaCl2, 80mM KCl, 10% (V/V) hexylene glycol, 12mM spermine, 40mM Na-cacodylate pH 7