6DQO

Crystal structure of SsuE FMN reductase Y118A mutant in FMN bound form.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-2
Synchrotron site	SSRL
Beamline	BL12-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-05-05
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97946
Spacegroup name	C 2 2 21
Unit cell lengths	80.911, 110.847, 41.727
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	33.336 - 1.705
R-factor	0.185
Rwork	0.184
R-free	0.20700
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.011
RMSD bond angle	1.274
Data reduction software	XDS
Data scaling software	autoPROC
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	33.340	1.790
High resolution limit [Å]	1.705	1.705
Number of reflections	20861
<I/σ(I)>	24.9	2.1
Completeness [%]	99.6
Redundancy	13.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	200 mM sodium thiocyanate pH 6.9, 20 % (w/v) PEG 3350