8XDO

O-methyltransferase from Lycoris longituba complexed with Mg and SAH

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-1A
Synchrotron site	Photon Factory
Beamline	BL-1A
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-12-19
Detector	DECTRIS EIGER X 4M
Wavelength(s)	1.04500
Spacegroup name	P 2 21 21
Unit cell lengths	49.637, 81.183, 118.027
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.730 - 1.370
R-factor	0.1461
Rwork	0.145
R-free	0.16830
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.012
RMSD bond angle	1.320
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.730	1.390
High resolution limit [Å]	1.370	1.370
Rmerge	0.089	1.249
Number of reflections	193630	4947
<I/σ(I)>	16.9	2.2
Completeness [%]	100.0	99.8
Redundancy	13.5	13
CC(1/2)	0.999	0.797

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	293	21 % (w/v) PEG 8000, 0.2M MgCl2, 0.1M Tris-HCl (pH 8.0)