9MGN

Crystal structure of PRMT5:MEP50 in complex with MTA and compound 41

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-D
Synchrotron site	APS
Beamline	21-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-03-09
Detector	DECTRIS EIGER X 9M
Wavelength(s)	1.07812
Spacegroup name	I 2 2 2
Unit cell lengths	101.650, 137.840, 179.090
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.800 - 2.820
R-factor	0.23134
Rwork	0.229
R-free	0.28094
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.002
RMSD bond angle	1.292
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	REFMAC (5.8.0238)
Refinement software	REFMAC (5.8.0238)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.800	2.890
High resolution limit [Å]	2.820	2.820
Rmerge	0.122	1.154
Rmeas	0.126	1.197
Rpim	0.034	0.317
Total number of observations		30718
Number of reflections	30319	2184
<I/σ(I)>	14.2	2.2
Completeness [%]	98.9
Redundancy	13.5	14.1
CC(1/2)	0.998	0.924

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	291	10% PEG 4000, 0.1 M sodium citrate (pH 6.0), 0.2 M magnesium chloride