5XUY

Crystal structure of ATG101-ATG13HORMA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	CCD
Collection date	2014-10-11
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9795
Spacegroup name	C 1 2 1
Unit cell lengths	87.990, 125.177, 100.760
Unit cell angles	90.00, 102.08, 90.00

Refinement procedure

Resolution	31.464 - 2.200
R-factor	0.2386
Rwork	0.237
R-free	0.27510
Structure solution method	SAD
RMSD bond length	0.004
RMSD bond angle	0.700
Data scaling software	HKL-2000
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.240
High resolution limit [Å]	2.200	5.970	2.200
Rmerge	0.062	0.032	0.636
Rmeas	0.072	0.037	0.733
Rpim	0.035	0.019	0.358
Total number of observations	214451
Number of reflections	53628
<I/σ(I)>	15.3
Completeness [%]	99.0	84.7	98.6
Redundancy	4	3.8	3.8
CC(1/2)		0.998	0.843

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1M HEPES (pH7.5), 0.2M MgCl2, 6-8% (w/v) PEG 3350