7S03

DNA-binding domain of human SETMAR in complex with Hsmar1 terminal inverted repeat (TIR) DNA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-D
Synchrotron site	APS
Beamline	23-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-03-19
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97938
Spacegroup name	C 2 2 21
Unit cell lengths	70.978, 166.172, 66.052
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	27.700 - 2.370
R-factor	0.212
Rwork	0.211
R-free	0.23500
Structure solution method	SAD
RMSD bond length	0.010
RMSD bond angle	0.960
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	BUSTER (2.10.2)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	27.700	2.460
High resolution limit [Å]	2.370	2.370
Rmerge	0.044	0.459
Rmeas	0.050	0.528
Rpim	0.024	0.256
Number of reflections	16176	1650
<I/σ(I)>	21.9	2.3
Completeness [%]	99.7	99.1
Redundancy	4.3	4
CC(1/2)	0.999	0.910

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293	0.1 M magnesium formate, 15% PEG3350