6UAV

Crystal structure of a GH128 (subgroup II) endo-beta-1,3-glucanase from Pseudomonas viridiflava (PvGH128_II)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	LNLS BEAMLINE W01B-MX2
Synchrotron site	LNLS
Beamline	W01B-MX2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-07-10
Detector	DECTRIS PILATUS 2M
Wavelength(s)	1.239860
Spacegroup name	C 1 2 1
Unit cell lengths	87.663, 33.648, 84.259
Unit cell angles	90.00, 113.06, 90.00

Refinement procedure

Resolution	40.330 - 1.500
R-factor	0.17224
Rwork	0.171
R-free	0.20034
Structure solution method	SIRAS
RMSD bond length	0.014
RMSD bond angle	1.817
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	SHELXDE
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.450	1.590
High resolution limit [Å]	1.500	1.500
Rmerge	0.091	0.844
Rmeas	0.100	0.941
Number of reflections	36444	5775
<I/σ(I)>	12.19	1.74
Completeness [%]	99.2	98.1
Redundancy	5.38	5.06
CC(1/2)	0.999	0.702

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	291	ammonium sulfate 2 M bis-tris 0.1 M