6IFB

Structure of rhamnose bound beta-trefoil lectin from Entamoeba histolytica

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-05-04
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9686
Spacegroup name	P 21 21 21
Unit cell lengths	57.194, 62.377, 67.410
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.780 - 1.370
R-factor	0.159
Rwork	0.158
R-free	0.17660
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.014
RMSD bond angle	1.793
Data reduction software	XDS (2018-04-27)
Data scaling software	XDS (2018-04-27)
Phasing software	PHASER (2.7.0)
Refinement software	REFMAC (5.8.0230)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.780	1.419
High resolution limit [Å]	1.370	1.370
Number of reflections	50944	7723
<I/σ(I)>	14.58	2.3
Completeness [%]	99.0	94.3
Redundancy	8.47	7.55

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		289.15	20% iso-propanol, 0.1M MES monohydrate, pH 6.0, 20% PEG monomethyl ether 2000