1E1Q

BOVINE MITOCHONDRIAL F1-ATPASE AT 100K

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID2
Synchrotron site	ESRF
Beamline	ID2
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	1996-02-21
Detector	MARRESEARCH
Spacegroup name	P 21 21 21
Unit cell lengths	280.800, 107.400, 139.600
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	20.000 - 2.610
Rwork	0.232
R-free	0.28000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDB CODE 1BMF BOVINE MITOCHONDRIAL F1-ATPASE
RMSD bond length	0.011
RMSD bond angle	0.027
Data reduction software	MOSFLM
Data scaling software	CCP4
Phasing software	AMoRE
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.750
High resolution limit [Å]	2.610	2.610
Rmerge	0.061	0.202
Number of reflections	121408
<I/σ(I)>	18.1	7.1
Completeness [%]	94.8	99.1
Redundancy	3.03	2.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Microdialysis *	8.2 *		pH 8.00

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	1	deuterium oxide	99.9 (%)
10	1	1	AMP-PNP	0.5 (Mm)
11	1	1	ADP	10 (Mm)
12	1	2	deutrium oxide	99.9 (%)
13	1	2	Tris-HCl	50 (mM)
14	1	2	PEG6000	9 (%(w/v))
15	1	2	sodium chloride	200 (mM)	1 mM EDTA, 0.02%(w/v) sidium azide, 5mM 2-mercaptoethanol, 0.001% PMSF, 5mM dithiothreitol, 20mM magnesiumsulphate, 0.25mMAMP-PNP, 0.005mM ADP.
2	1	1	Tris-HCl	100 (mM)
3	1	1	PEG6000	14 (%(w/v))
4	1	1	sodium chloride	400 (mM)
5	1	1	EDTA	2 (mM)
6	1	1	sodium azide	0.04 (%(w/v))
7	1	1	PMSF	0.02 (%(w/v))
8	1	1	dithiothreitol	10 (Mm)
9	1	1	magnesium chloride	8 (Mm)