6DV2

Crystal Structure of Human Mitochondrial Trifunctional Protein

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 17-BM
Synchrotron site	APS
Beamline	17-BM
Temperature [K]	100
Detector technology	PIXEL
Collection date	2010-10-25
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	1.0
Spacegroup name	P 1 21 1
Unit cell lengths	136.536, 237.938, 141.319
Unit cell angles	90.00, 105.61, 90.00

Refinement procedure

Resolution	89.560 - 3.600
R-factor	0.244
Rwork	0.244
R-free	0.28900
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1afw 2wtb
RMSD bond length	0.003
RMSD bond angle	0.800
Data reduction software	MOSFLM
Data scaling software	SCALA (3.3.16)
Phasing software	PHASER
Refinement software	CNS (1.3)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	89.574	89.574	3.790
High resolution limit [Å]	3.600	11.380	3.600
Rmerge		0.017	0.728
Rmeas	0.132	0.023	0.910
Rpim	0.057	0.010	0.394
Total number of observations	530931
Number of reflections	100350	3236	14624
<I/σ(I)>	13.2	33.5	1.1
Completeness [%]	99.9	99.3	100
Redundancy	5.3	5.2	5.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION	7	292	0.1 M Heps pH 7.0, 12% pEG3350 and 0.2 M MgCl2