8HAR

SAH-bound C-Methyltransferase Fur6 from Streptomyces sp. KO-3988

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL32XU
Synchrotron site	SPring-8
Beamline	BL32XU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-07-21
Detector	DECTRIS EIGER X 9M
Wavelength(s)	1.000
Spacegroup name	P 21 21 21
Unit cell lengths	74.980, 91.840, 125.350
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.134 - 2.120
Rwork	0.211
R-free	0.25610
Structure solution method	SAD
RMSD bond length	0.004
RMSD bond angle	1.300
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	CRANK2
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.180
High resolution limit [Å]	2.120	2.120
Number of reflections	94785	6960
<I/σ(I)>	5.93
Completeness [%]	100.0
Redundancy	8.1
CC(1/2)	0.984	0.813

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293	PEG3350, calcium hydroxide, HEPES-NaOH