3A7O

The crystal structure of the coiled-coil domain of Saccharomyces cerevisiae Atg16

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL41XU
Synchrotron site	SPring-8
Beamline	BL41XU
Temperature [K]	95
Detector technology	CCD
Collection date	2008-07-08
Detector	RAYONIX MX-225
Wavelength(s)	1.1000
Spacegroup name	P 43 21 2
Unit cell lengths	127.891, 127.891, 77.808
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.080 - 2.500
R-factor	0.273
Rwork	0.272
R-free	0.29900
Structure solution method	SAD
RMSD bond length	0.006
RMSD bond angle	1.000
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	SOLVE
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.590
High resolution limit [Å]	2.500	2.500
Rmerge	0.069	0.282
Number of reflections	22847
<I/σ(I)>	19.4
Completeness [%]	99.9	100
Redundancy	17.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5	293	0.8M ammonium chloride, 0.1M sodium acetate, pH 5.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K
1	VAPOR DIFFUSION, SITTING DROP	5	293	0.8M ammonium chloride, 0.1M sodium acetate, pH 5.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K