6JMS

CJP38, a beta-1,3-glucanase and allergen of Cryptomeria japonica pollen

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-17A
Synchrotron site	Photon Factory
Beamline	BL-17A
Temperature [K]	95
Detector technology	CCD
Collection date	2015-12-16
Detector	ADSC QUANTUM 270
Wavelength(s)	0.98
Spacegroup name	P 41
Unit cell lengths	71.423, 71.423, 63.447
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.711 - 1.500
R-factor	0.14913
Rwork	0.148
R-free	0.16821
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2cyg
RMSD bond length	0.010
RMSD bond angle	1.527
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.530
High resolution limit [Å]	1.500	1.500
Rpim	0.016	0.116
Number of reflections	50705	2499
<I/σ(I)>	35.5
Completeness [%]	99.4
Redundancy	13.3
CC(1/2)		0.958

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.2 M calcium chloride, 20% Polyethylene glycol 3350