5GW1

Crystal structure of SNX16 PX-Coiled coil in space group P212121

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2011-04-18
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97915
Spacegroup name	P 21 21 21
Unit cell lengths	75.670, 133.060, 215.370
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.995 - 3.350
R-factor	0.2586
Rwork	0.257
R-free	0.28630
RMSD bond length	0.008
RMSD bond angle	1.468
Data reduction software	Aimless
Data scaling software	Aimless (0.5.12)
Phasing software	MOLREP
Refinement software	PHENIX (1.8.1_1168)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	61.910	61.910	3.530
High resolution limit [Å]	3.350	10.590	3.350
Rmerge	0.098	0.057	0.704
Rmeas	0.112	0.066	0.799
Rpim	0.053	0.032	0.371
Total number of observations	139054	4270	20585
Number of reflections	32016
<I/σ(I)>	13.8	43.3	2.5
Completeness [%]	99.7	96.2	99.9
Redundancy	4.3	4	4.5
CC(1/2)	0.994	0.986	0.683

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	7.5	277	31mM Citric, 69mM Bis-tris Propanol, 18% PEG 5000, 70mM NaF, 2mM TCEP