5EGC

Structure of the Adeno-Associated Virus Serotype 1 sialic acid complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CHESS BEAMLINE A1
Synchrotron site	CHESS
Beamline	A1
Temperature [K]	100
Detector technology	CCD
Collection date	2009-04-19
Detector	ADSC QUANTUM 210
Wavelength(s)	0.9791
Spacegroup name	C 1 2 1
Unit cell lengths	455.627, 261.749, 450.980
Unit cell angles	90.00, 111.06, 90.00

Refinement procedure

Resolution	49.923 - 3.011
R-factor	0.2688
Rwork	0.269
R-free	0.27640
RMSD bond length	0.008
RMSD bond angle	1.065
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	3.050
High resolution limit [Å]	3.000	8.130	3.000
Rmerge	0.163	0.071	0.468
Rmeas	0.205	0.090	0.624
Rpim	0.123	0.054	0.409
Total number of observations	1170740
Number of reflections	593352
<I/σ(I)>	5.1
Completeness [%]	61.6	63.3	44.6
Redundancy	2	2.3	1.5
CC(1/2)		0.991	0.862

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.3	298	0.1 M HEPES-NaOH pH 7.3, 0.05 M MgCl2, 0.03% NaN3, 1.0 M NaCl, 7% PEG 6K and 25% glycerol