3UIT

Overall structure of Patj/Pals1/Mals complex

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	2010-04-23
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.9791
Spacegroup name	P 61 2 2
Unit cell lengths	145.194, 145.194, 202.547
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	38.863 - 2.050
R-factor	0.1817
Rwork	0.180
R-free	0.22050
Structure solution method	SAD
RMSD bond length	0.007
RMSD bond angle	1.006
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((phenix.refine: 1.6.4_486))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.120
High resolution limit [Å]	2.050	2.050
Rmerge	0.063
Number of reflections	79261
<I/σ(I)>	36.2
Completeness [%]	87.7	100
Redundancy	20.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	293	2.8M sodium acetate, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K
1	VAPOR DIFFUSION, SITTING DROP	7	293	2.8M sodium acetate, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K