2XND

Crystal structure of bovine F1-c8 sub-complex of ATP Synthase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	CCD
Collection date	2010-05-02
Detector	MARRESEARCH
Spacegroup name	P 21 21 21
Unit cell lengths	155.740, 157.100, 247.270
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	132.600 - 3.500
R-factor	0.26341
Rwork	0.261
R-free	0.30397
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1e79
RMSD bond length	0.006
RMSD bond angle	0.996
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	REFMAC (5.5.0109)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	132.600	3.590
High resolution limit [Å]	3.500	3.500
Rmerge	0.260	0.820
Number of reflections	72959
<I/σ(I)>	3.7	1.6
Completeness [%]	99.6	99.5
Redundancy	3.6	3.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		7		CRYSTALS WERE GROWN UNDER OIL BY MIXING EQUAL VOLUMES OF PROTEIN (10MG/ML IN 20MM TRIS PH 8.0, 10% GLYCEROL, 1MM ADP, 1MM AMP-PNP, 2MM MGSO4, 0.02% NAN3, 5.7MM TDM) AND PRECIPITANT SOLUTION (50MM HEPES PH 7.0, 14% PEG4600, 50MM K2HPO4)