6R9U

Human Cyclophilin D in complex with fragment

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-07-18
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.99999
Spacegroup name	P 43 21 2
Unit cell lengths	56.964, 56.964, 114.661
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	51.020 - 1.260
Rwork	0.149
R-free	0.17200
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4j5b
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	MOLREP
Refinement software	REFMAC (5.6.0117)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	51.020	1.510
High resolution limit [Å]	1.260	1.260
Rmerge	0.059	0.578
Number of reflections	51798	21350
<I/σ(I)>	23.09
Completeness [%]	100.0	100
Redundancy	15.7	15

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.2	298	50 mM potassium phosphate