24FP

Dextran glucosidase SmDG E236S in complex with panose

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-1A
Synchrotron site	Photon Factory
Beamline	BL-1A
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-12-16
Detector	DECTRIS EIGER X 4M
Wavelength(s)	1.07
Spacegroup name	P 21 21 21
Unit cell lengths	73.330, 84.665, 104.409
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.958 - 2.403
R-factor	0.2266
Rwork	0.224
R-free	0.26030
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.430
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.550
High resolution limit [Å]	2.400	2.400
Number of reflections	25906	4080
<I/σ(I)>	8.87
Completeness [%]	99.7
Redundancy	6.85
CC(1/2)	0.992	0.656

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	50mM Tris-HCl buffer (pH 7.5), 100mM CaCl2, 6% PEG 6000, 40mM panose, 11mg/mL SmDG E236S