3KMT

Crystal structure of vSET/SAH/H3 ternary complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X6A
Synchrotron site	NSLS
Beamline	X6A
Temperature [K]	160
Detector technology	CCD
Collection date	2009-11-02
Detector	ADSC QUANTUM 210
Wavelength(s)	1.0000
Spacegroup name	C 1 2 1
Unit cell lengths	155.085, 38.722, 73.208
Unit cell angles	90.00, 107.80, 90.00

Refinement procedure

Resolution	20.000 - 1.780
R-factor	0.21
Rwork	0.196
R-free	0.22400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3kma
RMSD bond length	0.006
RMSD bond angle	1.300
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	CNS (1.1)

Data quality characteristics

	Overall
Low resolution limit [Å]	20.000
High resolution limit [Å]	1.780
Number of reflections	40039
Completeness [%]	99.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.3	293	26% PEG 4000, 0.1 M sodium citrate pH 6.3, 5% isopropanol, VAPOR DIFFUSION, HANGING DROP, temperature 293K