2VB0

Crystal structure of coxsackievirus B3 proteinase 3C

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	EMBL/DESY, HAMBURG BEAMLINE X13
Synchrotron site	EMBL/DESY, HAMBURG
Beamline	X13
Temperature [K]	100
Detector technology	CCD
Collection date	2003-10-23
Detector	MARRESEARCH
Spacegroup name	C 1 2 1
Unit cell lengths	78.706, 64.550, 39.196
Unit cell angles	90.00, 115.71, 90.00

Refinement procedure

Resolution	35.360 - 2.400
R-factor	0.21
Rwork	0.207
R-free	0.26600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	HAV 3CPRO
RMSD bond length	0.017
RMSD bond angle	1.837
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	EPMR
Refinement software	REFMAC (5.3.0037)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	35.360	2.460
High resolution limit [Å]	2.400	2.400
Rmerge	0.110	0.400
Number of reflections	6931
<I/σ(I)>	11.95	4
Completeness [%]	99.7	97.4
Redundancy	5.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		5.5		pH 5.5