1C1F

LIGAND-FREE CONGERIN I

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-6A
Synchrotron site	Photon Factory
Beamline	BL-6A
Temperature [K]	291
Detector technology	IMAGE PLATE
Detector	FUJI
Spacegroup name	P 21 21 2
Unit cell lengths	94.340, 36.920, 40.540
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	8.000 - 1.600
R-factor	0.201 *
Rwork	0.201
R-free	0.24700
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.011
RMSD bond angle	2.600
Data reduction software	DENZO
Data scaling software	SCALEPACK
Refinement software	X-PLOR (3.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	1.660
High resolution limit [Å]	1.600	1.600
Rmerge	0.046
Number of reflections	17489
Completeness [%]	91.1	76.1
Redundancy	3.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, hanging drop *	7 *	18 *	pH 9.0

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	reservoir	PEG6000	25 (%(w/v))
2	1	reservoir	Tris-HCl	0.1 (M)
3	1	drop	protein	20 (mg/ml)
4	1	drop	Tris-HCl	10 (mM)