6K4J

Crystal Structure of the the CD9

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL32XU
Synchrotron site	SPring-8
Beamline	BL32XU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-09-21
Detector	DECTRIS EIGER X 9M
Wavelength(s)	1.0
Spacegroup name	C 2 2 21
Unit cell lengths	45.180, 125.210, 129.400
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.498 - 2.701
R-factor	0.2647
Rwork	0.262
R-free	0.28890
Structure solution method	SIRAS
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	42.498	42.498	2.860
High resolution limit [Å]	2.700	8.080	2.700
Rmerge	0.051	0.097	3.135
Rmeas	0.518	0.098	3.162
Total number of observations	604284
Number of reflections	10431	438	1623
<I/σ(I)>	15.83	65.52	1.7
Completeness [%]	100.0	99.1	100
Redundancy	57.932	57.135	59.792
CC(1/2)	0.998	0.999	0.513

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	LIPIDIC CUBIC PHASE	6.5	298	PEG 200