3F6J

F17a-G lectin domain with bound GlcNAc(beta1-3)Gal

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	EMBL/DESY, HAMBURG BEAMLINE X11
Synchrotron site	EMBL/DESY, HAMBURG
Beamline	X11
Temperature [K]	100
Detector technology	CCD
Collection date	2006-05-01
Detector	MAR CCD 165 mm
Wavelength(s)	0.8047
Spacegroup name	P 61 2 2
Unit cell lengths	42.801, 42.801, 284.628
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	32.870 - 1.750
R-factor	0.193
Rwork	0.191
R-free	0.23200
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1O9V chain A
RMSD bond length	0.012
RMSD bond angle	1.316
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	CNS
Refinement software	REFMAC (5.2.0005)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.860
High resolution limit [Å]	1.750	1.750
Rmerge	0.126	0.399
Number of reflections	15865
<I/σ(I)>	16.88	4.5
Completeness [%]	94.4	90.9
Redundancy	16.3	8.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	7.5	293	10%(v/v) 2-propanol, 20%(w/v) PEG 4000, 100mM HEPES, pH 7.5, vapor diffusion, temperature 293K