9F83

SARS-CoV-2 Nucleocapsid N-terminal domain (NTD) mutant D63G

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	2023-03-20
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.976
Spacegroup name	P 1 21 1
Unit cell lengths	59.013, 55.665, 84.895
Unit cell angles	90.00, 95.15, 90.00

Refinement procedure

Resolution	50.479 - 1.700
Rwork	0.229
R-free	0.28020
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.014
RMSD bond angle	2.083
Data reduction software	autoPROC (1.17)
Data scaling software	Aimless (0.7.13)
Phasing software	PHASER (2.8.3)
Refinement software	REFMAC (5.8.0425)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	84.550	84.550	1.730
High resolution limit [Å]	1.700	9.000	1.700
Rmerge	0.078	0.049	1.101
Rmeas	0.093	0.058	1.303
Rpim	0.049	0.032	0.688
Number of reflections	59866	440	3151
<I/σ(I)>	12.1
Completeness [%]	98.9
Redundancy	6.6	6	6.8
CC(1/2)	0.998	0.994	0.736

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	293	50mM HEPES pH 6.8 150mM Sodium Chloride 24% PEG 3350 2% PEG 400