6MGB

Thermosulfurimonas dismutans KpsC, beta Kdo 2,4 transferase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08ID-1
Synchrotron site	CLSI
Beamline	08ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-07-27
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.97949
Spacegroup name	P 21 21 21
Unit cell lengths	50.020, 65.540, 121.080
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.230 - 1.800
R-factor	0.1838
Rwork	0.183
R-free	0.21280
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.542
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.850
High resolution limit [Å]	1.800	1.800
Number of reflections	37637	2738
<I/σ(I)>	7.9	1.74
Completeness [%]	99.9	100
Redundancy	6.2	6
CC(1/2)		0.730

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	293	0.2 M magnesium chloride hexahydrate, 0.1 M Tris-HCl, pH 7.0, 10% v/v PEG8000, 10 mg/mL protein with 1 mM CMP, 50 mM L-Arg