5YNJ

Crystal structure of MERS-CoV nsp16/nsp10 complex bound to m7GpppG

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-03-03
Detector	DECTRIS PILATUS3 R CdTe 300K
Wavelength(s)	0.9778
Spacegroup name	P 21 2 21
Unit cell lengths	67.041, 70.516, 118.921
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.457 - 2.043
R-factor	0.1962
Rwork	0.195
R-free	0.22130
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3r24
RMSD bond length	0.003
RMSD bond angle	1.176
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.600
High resolution limit [Å]	2.040	2.040
Rmerge	0.067
Rmeas	0.070
Rpim	0.021
Number of reflections	72944	3576
<I/σ(I)>	21.9	3.3
Completeness [%]	99.8	99.1
Redundancy	10.6	10
CC(1/2)	0.999	0.903

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	290	10% PEG 5000 ME, 5% Tascimate