3W9Z

Crystal structure of DusC

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-5A
Synchrotron site	Photon Factory
Beamline	BL-5A
Temperature [K]	100
Detector technology	CCD
Collection date	2011-10-15
Detector	ADSC QUANTUM 210r
Wavelength(s)	1
Spacegroup name	P 43 21 2
Unit cell lengths	93.252, 93.252, 115.499
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.097 - 2.100
R-factor	0.2213
Rwork	0.221
R-free	0.23520
Structure solution method	SAD
RMSD bond length	0.008
RMSD bond angle	1.168
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	SHELX
Refinement software	PHENIX (1.8.2_1309)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.140
High resolution limit [Å]	2.100	2.100
Number of reflections	30439
<I/σ(I)>	71.7	5.3
Completeness [%]	99.9	100
Redundancy	15.3	14.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	7.9	293	0.1M Tris pH7.9, 0.2M Na Acetate, 12% PEG 4000, VAPOR DIFFUSION, temperature 293K
2	VAPOR DIFFUSION	8	293	0.1M Imidazole pH8.0, 15% Isopropanol, 20% Glycerol , VAPOR DIFFUSION, temperature 293K