6B8K

Crystal structure of Human galectin-3 CRD in complex with Lactulose

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX1
Synchrotron site	Australian Synchrotron
Beamline	MX1
Temperature [K]	100
Detector technology	CCD
Collection date	2016-10-13
Detector	ADSC QUANTUM 210r
Wavelength(s)	0.953
Spacegroup name	P 21 21 21
Unit cell lengths	36.170, 57.870, 62.600
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.670 - 1.280
R-factor	0.165
Rwork	0.163
R-free	0.19525
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.029
RMSD bond angle	2.679
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0135)

Data quality characteristics

	Overall
Low resolution limit [Å]	30.670
High resolution limit [Å]	1.280
Number of reflections	34451
<I/σ(I)>	23.4
Completeness [%]	99.6
Redundancy	12.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	31% PEG6000, 100 mM magnesium chloride, 8 mM BME, 100 mM Tris-HCl, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K