5SWJ

Crystal Structure of ATPase delta1-79 Spa47

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL7-1
Synchrotron site	SSRL
Beamline	BL7-1
Temperature [K]	100
Detector technology	CCD
Collection date	2016-04-15
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.127
Spacegroup name	P 1 21 1
Unit cell lengths	43.964, 153.923, 54.630
Unit cell angles	90.00, 109.83, 90.00

Refinement procedure

Resolution	35.074 - 2.401
R-factor	0.1978
Rwork	0.196
R-free	0.23660
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2dpy
RMSD bond length	0.004
RMSD bond angle	0.887
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.490
High resolution limit [Å]	2.400	5.170	2.400
Rmerge	0.252	0.111	1.670
Number of reflections	26525
<I/σ(I)>	3.9		1.2
Completeness [%]	99.6	99.4	99.7
Redundancy	7	7.5	6.7
CC(1/2)	0.988	0.994	0.400

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	8.5	298	Tris, Ammonium Acetate, Lithium Sulfate, PEG 4000, MPD