4ETQ

Vaccinia virus D8L IMV envelope protein in complex with Fab of murine IgG2a LA5

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL11-1
Synchrotron site	SSRL
Beamline	BL11-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2010-12-15
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.98
Spacegroup name	P 1 21 1
Unit cell lengths	76.021, 91.156, 103.774
Unit cell angles	90.00, 107.32, 90.00

Refinement procedure

Resolution	36.200 - 2.100
R-factor	0.2026
Rwork	0.202
R-free	0.25190
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDB ENTRIES 1NSN AND 3JXF
RMSD bond length	0.008
RMSD bond angle	1.123
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	MOLREP
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	40.000	40.000	2.180
High resolution limit [Å]	2.100	4.520	2.100
Rmerge	0.086	0.047	0.459
Number of reflections	77173
<I/σ(I)>	10.6
Completeness [%]	97.8	95.4	93.2
Redundancy	3.1	3.2	3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		295	0.2 M potassium thiocyanate, 20% PEG3350, VAPOR DIFFUSION, SITTING DROP, temperature 295K