4I98

Crystal structure of the complex between ScpA(residues 1-160)-ScpB(residues 1-183)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 4A
Synchrotron site	PAL/PLS
Beamline	4A
Temperature [K]	100
Detector technology	CCD
Collection date	2012-05-22
Detector	ADSC QUANTUM 315
Wavelength(s)	0.97932
Spacegroup name	C 1 2 1
Unit cell lengths	185.297, 82.720, 59.909
Unit cell angles	90.00, 98.92, 90.00

Refinement procedure

Resolution	39.270 - 2.800
Rwork	0.240
R-free	0.25900
Structure solution method	SAD
RMSD bond length	0.008
RMSD bond angle	1.200
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	SOLVE
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.850
High resolution limit [Å]	2.800	2.800
Rmerge	0.082	0.950
Number of reflections	22286
<I/σ(I)>	42.9	2.79
Completeness [%]	99.9	100
Redundancy	7.4	7.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	293	200mM trimethylamine N-oxide, 100mM Tris-HCl, 20% polyethylene glycol monomethyl ether 2000, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K