9HL2

Structure of A56/K2 (vaccinia virus)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 2
Synchrotron site	SOLEIL
Beamline	PROXIMA 2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-07-02
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.980096
Spacegroup name	P 41 21 2
Unit cell lengths	74.372, 74.372, 216.330
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.700 - 2.800
R-factor	0.236
Rwork	0.233
R-free	0.28710
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.522
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.21.2_5419)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.700	2.950
High resolution limit [Å]	2.800	2.800
Number of reflections	15779	2233
<I/σ(I)>	10.5
Completeness [%]	99.9
Redundancy	7.9
CC(1/2)	0.997	0.638

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	0.2 M Na3 citrate, 0.1 M TRIS pH 8.5, 30% v/v PEG 400