7NR4

X-RAY STRUCTURE OF PRMT6 IN COMPLEX WITH indazole type inhibitor

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P13 (MX1)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-12-18
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.0332
Spacegroup name	P 1 21 1
Unit cell lengths	77.936, 135.252, 83.197
Unit cell angles	90.00, 98.28, 90.00

Refinement procedure

Resolution	49.050 - 2.030
R-factor	0.1987
Rwork	0.198
R-free	0.23520
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5egs
RMSD bond length	0.009
RMSD bond angle	1.651
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.050	2.150
High resolution limit [Å]	2.030	2.030
Number of reflections	109556	17601
<I/σ(I)>	9.2
Completeness [%]	99.6
Redundancy	3.8
CC(1/2)	0.997	0.497

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	25 % PEG 1500; 0.1 M MMT pH 8.0