5WEY

Joint X-ray/neutron structure of Concanavalin A with alpha1-2 D-mannobiose

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	293
Detector technology	IMAGE PLATE
Collection date	2015-07-13
Detector	RIGAKU RAXIS IV++
Wavelength(s)	1.54
Spacegroup name	I 2 2 2
Unit cell lengths	66.563, 86.618, 91.808
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.000 - 2.500
Rwork	0.247
R-free	0.28500
Refinement software	nCNS (1.0.0)

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	1.800
Number of reflections	23395
<I/σ(I)>	25.1
Completeness [%]	93.7
Redundancy	4.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5	291	10% PEG 6K, 0.1 M sodium citrate, pH 5 in H2O
2