1QNX

Ves v 5, an allergen from Vespula vulgaris venom

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	MAX II BEAMLINE I711
Synchrotron site	MAX II
Beamline	I711
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	1999-03-15
Detector	MARRESEARCH
Spacegroup name	P 21 21 21
Unit cell lengths	45.359, 62.179, 82.777
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 1.900
R-factor	0.209
Rwork	0.209
R-free	0.23600
Structure solution method	MIRAS
RMSD bond length	0.006
RMSD bond angle	23.300 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	CNS (0.5)
Refinement software	CNS (0.5)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	1.970
High resolution limit [Å]	1.900	1.900
Rmerge	0.067 *	0.178 *
Number of reflections	17809
Completeness [%]	93.2	98.9
Redundancy	8.1	3.6 *

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, sitting drop *	5.6		18% PEG6000, 0.1M CITRTE BUFFER PH 5.6

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	reservoir	PEG6000	16-20 (%(w/v))
2	1	reservoir	citrate	100 (mM)
3	1	drop	protein	5 (mg/ml)