6ONO

Complex structure of WhiB1 and region 4 of SigA in C2221 space group

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	2017-12-02
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9793
Spacegroup name	C 2 2 21
Unit cell lengths	37.445, 114.080, 144.713
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.790 - 1.850
R-factor	0.1967
Rwork	0.195
R-free	0.23700
Structure solution method	SAD
RMSD bond length	0.006
RMSD bond angle	0.871
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	AutoSol
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.880
High resolution limit [Å]	1.850	1.850
Rmerge	0.095	0.894
Rmeas	0.091	1.121
Rpim	0.018	0.258
Number of reflections	24510	736
<I/σ(I)>	36.8	0.84
Completeness [%]	91.5	56.4
Redundancy	22.1	13.2
CC(1/2)	0.998	0.822

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	291	100 mM Bis-Tris, pH 5.5, 200 mM magnesium chloride, 25% PEG3350