6T1D

Pleurotus Ostreatus Lectin (POL), compelx with melibiose

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-2
Synchrotron site	ESRF
Beamline	ID23-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-06-22
Detector	DECTRIS PILATUS 2M
Wavelength(s)	0.87313
Spacegroup name	P 1 21 1
Unit cell lengths	109.605, 136.421, 110.022
Unit cell angles	90.00, 112.37, 90.00

Refinement procedure

Resolution	29.948 - 2.200
R-factor	0.2145
Rwork	0.212
R-free	0.26510
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6t0q
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	47.670	101.744	2.407
High resolution limit [Å]	2.090	7.172	2.093
Rmerge	0.151	0.055	0.821
Rmeas	0.179	0.065	0.968
Rpim	0.096	0.035	0.510
Total number of observations		14495	15880
Number of reflections	88942	4447	4447
<I/σ(I)>	6.6	15.8	1.7
Completeness [%]	92.5	99	65.5
Redundancy	3.4	3.3	3.6
CC(1/2)	0.989	0.996	0.467

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 K thiocyanate, 30% PEG 2000 MME