9GEI

Entamoeba histolytica Gal/GalNAc lectin heavy chain residues 808-992 in the presence of monoclonal antibody CP33-H/L-LA22

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-08-31
Detector	DECTRIS EIGER2 X 9M
Wavelength(s)	0.85506
Spacegroup name	P 21 21 2
Unit cell lengths	134.099, 151.982, 60.295
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	75.990 - 3.034
R-factor	0.2432
Rwork	0.241
R-free	0.27700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	8rz0
RMSD bond length	0.006
RMSD bond angle	0.850
Data reduction software	XDS
Data scaling software	STARANISO
Phasing software	PHASER
Refinement software	BUSTER (2.10.4 (26-JUL-2023))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	75.990	3.390
High resolution limit [Å]	3.030	3.030
Rpim	0.093	0.468
Number of reflections	16151	808
<I/σ(I)>	6.6
Completeness [%]	92.7
Redundancy	12.8
CC(1/2)	0.991	0.702

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		278	0.1 M Potassium chloride, 0.1M Bis-Tris, pH 6.0, 18%w/v PEG4000, 20 mM GalNAc +20% glycerol