2UXE

The structure of Vaccinia virus N1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	CCD
Detector	ADSC CCD
Spacegroup name	P 1 21 1
Unit cell lengths	71.682, 108.999, 70.088
Unit cell angles	90.00, 110.58, 90.00

Refinement procedure

Resolution	30.000 - 2.900
R-factor	0.2372
Rwork	0.237
R-free	0.24350
Structure solution method	MAD
RMSD bond length	0.014
RMSD bond angle	1.600
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	SOLVE
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	3.000
High resolution limit [Å]	2.900	2.900
Rmerge	0.140
Number of reflections	22319
<I/σ(I)>	17.9	1.8
Completeness [%]	100.0	100
Redundancy	11.9	11.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		6.2		0.2 M NA/K PHOSPHATE, 0.2 M NACL AND 10% PEG 8000, PH 6.2