6OCF

The crystal structure of VASH1-SVBP complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2018-03-15
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9792
Spacegroup name	I 41 2 2
Unit cell lengths	100.558, 100.558, 206.730
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.214 - 2.102
R-factor	0.1972
Rwork	0.196
R-free	0.22200
Structure solution method	SAD
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	AutoSol
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.140
High resolution limit [Å]	2.100	5.700	2.100
Rmerge	0.088	0.041	2.568
Rmeas	0.090	0.042	2.625
Rpim	0.018	0.009	0.528
Number of reflections	48368	1721	1476
<I/σ(I)>	42.8
Completeness [%]	99.6	99.7	97
Redundancy	24.5	24.4	20.4
CC(1/2)		0.999	0.547

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5	293.15	0.1 M sodium citrate tribasic dihydrate, pH 5.0, and 18% (w/v) PEG20000