6DRQ

The crystal structure of SatS c-terminal domain in complex with bromine

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-B
Synchrotron site	APS
Beamline	23-ID-B
Temperature [K]	129
Detector technology	PIXEL
Collection date	2015-03-26
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.902
Spacegroup name	P 21 21 21
Unit cell lengths	48.796, 50.596, 76.075
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.129 - 2.300
R-factor	0.2137
Rwork	0.209
R-free	0.29730
Structure solution method	SAD
RMSD bond length	0.007
RMSD bond angle	0.822
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX (HySS)
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	99.000	2.340
High resolution limit [Å]	2.300	2.300
Rmerge	0.050	0.105
Number of reflections	8721
<I/σ(I)>	27.4
Completeness [%]	99.2
Redundancy	3.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		289	3.5M ammonium citrate