8Y2Z

MPXV mRNA cap N7 methyltransferase

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	2023-11-04
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.987
Spacegroup name	P 65 2 2
Unit cell lengths	138.550, 138.550, 178.360
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	45.120 - 3.940
R-factor	0.2753
Rwork	0.273
R-free	0.31570
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.628
Data reduction software	DIALS
Data scaling software	xia2
Phasing software	PHASER
Refinement software	PHENIX ((1.18.2_3874: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.120	4.040
High resolution limit [Å]	3.940	3.940
Number of reflections	9470	9470
<I/σ(I)>	6.9
Completeness [%]	99.9
Redundancy	35.9	38.6
CC(1/2)	0.997	0.466

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	1600mM Sodium phosphate monobasic/ 400nM Potassium phosphate dibasic, 100mM Sodium phosphate dibasic/ Citric acid pH 4.2