9EVY

SARS-CoV-2 Nucleocapsid N-terminal domain (NTD) mutant E136D

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	2023-09-30
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97626
Spacegroup name	P 1 21 1
Unit cell lengths	58.865, 55.099, 84.591
Unit cell angles	90.00, 94.82, 90.00

Refinement procedure

Resolution	84.290 - 1.550
R-factor	0.21569
Rwork	0.215
R-free	0.23619
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	autoPROC (1.1.7)
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]	84.292	84.290	1.580
High resolution limit [Å]	1.550	8.490	1.550
Rmerge	0.053	0.053	0.395
Rmeas	0.064	0.066	0.478
Rpim	0.036	0.039	0.267
Number of reflections	76633	479	3771
<I/σ(I)>	16	26.8	3.9
Completeness [%]	97.9	91.3	97.5
Redundancy	5.9	4.6	5.9
CC(1/2)	0.997	0.993	0.924

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	293	100mM BICINE pH 9.3 20% PEG 3350