6WF2

Crystal structure of mouse SCD1 with a diiron center

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-02-15
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9791
Spacegroup name	P 21 21 21
Unit cell lengths	76.647, 113.981, 140.971
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	88.630 - 3.510
R-factor	0.2244
Rwork	0.219
R-free	0.27660
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4ymk
RMSD bond length	0.004
RMSD bond angle	0.680
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.17.1_3660: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	88.630	3.636
High resolution limit [Å]	3.510	3.510
Number of reflections	16020	1582
<I/σ(I)>	6.5
Completeness [%]	99.7
Redundancy	13.4
CC(1/2)	0.997	0.619

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	LIPIDIC CUBIC PHASE		293	100 mM Tris, pH7.8-8.2, PEG400 37-42%, 20 mM Mg(Ace)2, and 50 mM MgCl2