25YV

Crystal structure of SchOMT2 from Schisandra chinensis

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	2025-06-28
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97918
Spacegroup name	P 1
Unit cell lengths	44.554, 57.657, 79.930
Unit cell angles	87.85, 74.08, 75.45

Refinement procedure

Resolution	21.460 - 1.670
R-factor	0.238
Rwork	0.235
R-free	0.28640
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.986
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	76.820	1.710
High resolution limit [Å]	1.670	1.670
Rmerge	0.088	1.674
Rmeas	0.124
Rpim	0.088
Number of reflections	79609	10547
<I/σ(I)>	4.4
Completeness [%]	92.9	84.1
Redundancy	2.9	2.2
CC(1/2)	0.988	0.621

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		289	0.2M KCl 0.05M HEPES pH7.1 35% Pentaerythritol propoxylate(5/4 PO/OH)