6QLV

Crystal structure of W200H UbiX in complex with a geranyl-FMN N5 adduct

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-10-03
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.987
Spacegroup name	P 21 21 2
Unit cell lengths	161.533, 164.931, 102.527
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	115.400 - 2.391
R-factor	0.1786
Rwork	0.178
R-free	0.22020
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4zaf
RMSD bond length	0.002
RMSD bond angle	0.471
Data reduction software	DIALS
Data scaling software	DIALS
Phasing software	PHASER
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	115.400	2.476
High resolution limit [Å]	2.391	2.391
Rmerge	0.080
Number of reflections	108714
<I/σ(I)>	7.02
Completeness [%]	100.0
Redundancy	2
CC(1/2)	0.992

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		294	PGA screen (Molecular Dimensions) C3 0.1 M ammonium sulphate, 0.3 M sodium formate, 0.1 M sodium acetate, pH 5.0, 3 % (w/v) gamma polyglutamic acid (Na+ form, LM), 20% MPD