7LW3

Structure of SARS-CoV-2 nsp16/nsp10 complex in presence of Cap-1 analog (m7GpppAmU) and SAH

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-03-29
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	1.0711
Spacegroup name	P 31 2 1
Unit cell lengths	184.073, 184.073, 57.128
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	29.710 - 2.300
R-factor	0.2238
Rwork	0.222
R-free	0.25110
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6wks
RMSD bond length	0.027
RMSD bond angle	2.323
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	92.040	2.090
High resolution limit [Å]	2.050	2.050
Rmerge	0.089	1.800
Rmeas	0.094
Rpim	0.029
Number of reflections	69833	4389
<I/σ(I)>	15.2	0.9
Completeness [%]	99.9	98.6
Redundancy	10.3	10
CC(1/2)	0.999	0.445

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	293	10% (v/v) propanol, 0.01 M MES/NaOH pH 6.0, 0.2 M calcium acetate