8FTS

SgvM methyltransferase with SAH and alpha-ketoleucine

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2021-11-20
Detector	MAR scanner 300 mm plate
Wavelength(s)	0.97856
Spacegroup name	P 43 21 2
Unit cell lengths	68.347, 68.347, 186.207
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	25.000 - 2.200
R-factor	0.21282
Rwork	0.211
R-free	0.24590
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	1.155
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.133	2.207
High resolution limit [Å]	2.200	2.200
Rmerge	0.113	1.823
Number of reflections	23134	5110
<I/σ(I)>	15.8
Completeness [%]	99.4
Redundancy	21.7
CC(1/2)	0.999	0.792

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		283	PEG 3350 pH 7.5