1TEI

STRUCTURE OF CONCANAVALIN A COMPLEXED TO BETA-D-GLCNAC (1,2)ALPHA-D-MAN-(1,6)[BETA-D-GLCNAC(1,2)ALPHA-D-MAN (1,6)]ALPHA-D-MAN

Experimental procedure

Source type	ROTATING ANODE
Temperature [K]	293
Detector technology	IMAGE PLATE
Collection date	1996-10-29
Detector	MAC Science DIP-2000
Spacegroup name	C 1 2 1
Unit cell lengths	176.500, 122.800, 124.600
Unit cell angles	90.00, 134.20, 90.00

Refinement procedure

Resolution	25.000 - 2.700
R-factor	0.179
Rwork	0.179
R-free	0.21900
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5cna
RMSD bond length	0.010
RMSD bond angle	26.400 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	X-PLOR
Refinement software	X-PLOR

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	25.000
High resolution limit [Å]	2.700	2.700 *
Rmerge	0.094	0.337 *
Number of reflections	53516
Completeness [%]	97.1	95.8 *
Redundancy	4.2	4.1 *

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion *	5.5		POLYETHYLENE GLYCOL 15%, pH 5.5

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	sugar
2	1	drop	protein	6 (mg/ml)
3	1	drop		1 (mM)
4	1	drop		1 (mM)
5	1	reservoir	PEG6000	15 (%)