4W8V

Crystal structure of Cmr6 from Pyrococcus furiosus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2012-08-12
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.99994
Spacegroup name	I 21 21 21
Unit cell lengths	72.396, 127.731, 133.303
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	66.651 - 2.150
R-factor	0.1784
Rwork	0.176
R-free	0.22990
Structure solution method	SAD
RMSD bond length	0.008
RMSD bond angle	1.045
Data reduction software	XDS
Refinement software	PHENIX ((phenix.refine: 1.9_1678))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	66.650	2.227
High resolution limit [Å]	2.150	2.150
Number of reflections	64400
<I/σ(I)>	26.47	1.01
Completeness [%]	99.5	95.13
Redundancy	13.2	12

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293.15	2.4 M sodium malonate