6RLL

CRYSTAL STRUCTURE OF THE HUMAN PRMT5:MEP50 COMPLEX with JNJ44064146

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04-1
Synchrotron site	Diamond
Beamline	I04-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-02-16
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.91739
Spacegroup name	I 2 2 2
Unit cell lengths	102.956, 136.048, 179.298
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	89.440 - 2.220
R-factor	0.2529
Rwork	0.251
R-free	0.29110
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4gqb
RMSD bond length	0.012
RMSD bond angle	1.923
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0238)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	89.650	2.310
High resolution limit [Å]	2.220	2.220
Rmerge	0.058
Number of reflections	60395	6070
<I/σ(I)>	13.5
Completeness [%]	97.1	87.9
Redundancy	6.5
CC(1/2)	0.990	0.850

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	277	20-30% PEG3350; 150mM Ammonium Sulfate