5EB1

the YfiB-YfiR complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-1A
Synchrotron site	Photon Factory
Beamline	BL-1A
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-12-06
Detector	DECTRIS PILATUS 2M-F
Wavelength(s)	1.1
Spacegroup name	P 1
Unit cell lengths	49.499, 58.574, 69.863
Unit cell angles	72.93, 96.98, 90.19

Refinement procedure

Resolution	37.623 - 1.800
R-factor	0.1803
Rwork	0.179
R-free	0.20610
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4ny7 5eaz
RMSD bond length	0.007
RMSD bond angle	1.110
Data reduction software	d*TREK
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.860
High resolution limit [Å]	1.800	3.880	1.800
Rmerge	0.056	0.036	0.463
Rmeas	0.066	0.043	0.551
Rpim	0.036	0.023	0.296
Total number of observations	224013
Number of reflections	67774
<I/σ(I)>	6.9
Completeness [%]	96.5	97.1	94.6
Redundancy	3.3	3.3	3.3
CC(1/2)		0.996	0.849

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	293	0.2 M ammonium sulfate, 0.1 M Tris-HCl, 12%(w/v) polyethylene glycol 8000