8JC6

Crystal structure of Mpox virus A41L protein

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL10U2
Synchrotron site	SSRF
Beamline	BL10U2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-01-02
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.97918
Spacegroup name	P 21 21 21
Unit cell lengths	36.505, 74.887, 77.168
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.580 - 1.920
R-factor	0.208551755156
Rwork	0.206
R-free	0.25978
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.941
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX (1.12_2829)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	77.170	1.970
High resolution limit [Å]	1.920	1.920
Rmerge	0.052	0.134
Number of reflections	16689	1105
<I/σ(I)>	26.4
Completeness [%]	99.4
Redundancy	10.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.2 M Calcium acetate hydrate, 0.1M Sodium cacodylate trihydrate pH6.5, 18% Polyethylene glycol 8000