8BZ3

Structure od the carbohydrate reconition domain of Gal3 in comples with SAF-2-010

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-05-12
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.979260
Spacegroup name	P 21 21 21
Unit cell lengths	36.764, 57.983, 63.389
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.780 - 1.310
R-factor	0.1568
Rwork	0.154
R-free	0.19280
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	0.859
Data reduction software	autoPROC
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	57.980	1.340
High resolution limit [Å]	1.310	1.310
Rmerge	0.163	2.945
Rmeas	0.169	3.099
Number of reflections	29249	761
<I/σ(I)>	12.6	0.9
Completeness [%]	92.1	44.3
Redundancy	12.7	10.1
CC(1/2)	0.999	0.126

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	295	0.1 M TRIS-HCl at pH 8.5, 28% PEG 6000