4IC5

Crystal structure of Deg5

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2009-04-08
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.9792
Spacegroup name	C 1 2 1
Unit cell lengths	109.090, 125.952, 83.325
Unit cell angles	90.00, 102.91, 90.00

Refinement procedure

Resolution	49.883 - 2.607
R-factor	0.1844
Rwork	0.182
R-free	0.23210
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1l1j
RMSD bond length	0.007
RMSD bond angle	1.026
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASES
Refinement software	PHENIX ((phenix.refine: 1.7.1_743))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.600
High resolution limit [Å]	2.600	2.600
Number of reflections	33338
Completeness [%]	99.2	99.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	289	0.2M Calcium chloride dihydrate, 0.1M Tris-HCl, 25%(v/v) PEG400, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 289K