1H8H

Bovine mitochondrial F1-ATPase crystallised in the presence of 5mm AMPPNP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE BM14
Synchrotron site	ESRF
Beamline	BM14
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	1997-09-18
Detector	MARRESEARCH
Spacegroup name	P 21 21 21
Unit cell lengths	280.000, 107.000, 139.100
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	20.000 - 2.900
Rwork	0.236
R-free	0.29200
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDB CODE 1E1Q BOVINE MITOCHONDRIAL F1-ATPASE AT 100K
RMSD bond length	0.010
RMSD bond angle	0.026
Data reduction software	MOSFLM
Data scaling software	CCP4
Phasing software	AMoRE
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.270	3.070
High resolution limit [Å]	2.880	2.870
Rmerge	0.063	0.166
Total number of observations	217558 *
Number of reflections	79330 *
<I/σ(I)>	13.5	7.3
Completeness [%]	95.8	90.4
Redundancy	2.5	2.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Microdialysis *	8		solution 2 also includes 0.02%(w/v) sodium azide, 0.001%(w/v) phenylmethylsulphonyl fluoride, 5 mM dithiothreitol, 5mM AMPPNP, 0.005mM ADP and 11-12%(w/v) PEG6000 *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	1	protein	11 (mg/ml)
10	1	1	AMPPNP	2 (mM)
11	1	1	ADP	0.04 (mM)
12	1	2	Tri-sHCl	50 (mM)
13	1	2	sodium chloride	200 (mM)
14	1	2	EDTA	1 (mM)
15	1	2	magnesium sulphate	20 (mM)
2	1	1	Tris-HCl	100 (mM)
3	1	1	sodium chloride	400 (mM)
4	1	1	EDTA	2 (mM)
5	1	1	magnesium chloride	4 (mM)
6	1	1	sodium azide	0.04 (%(w/v))
7	1	1	phenylmethylsulphonyl fluoride	0.002 (%(w/v))
8	1	1	PEG6000	14 (%(w/v))
9	1	1	dithiothreitol	10 (mM)