1NBQ

Crystal Structure of Human Junctional Adhesion Molecule Type 1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X25
Synchrotron site	NSLS
Beamline	X25
Temperature [K]	100
Detector technology	CCD
Collection date	2001-10-02
Detector	CUSTOM-MADE
Wavelength(s)	1.1
Spacegroup name	C 1 2 1
Unit cell lengths	116.800, 61.800, 82.900
Unit cell angles	90.00, 120.01, 90.00

Refinement procedure

Resolution	30.000 - 2.900
R-factor	0.2201
Rwork	0.220
R-free	0.30500
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.020
RMSD bond angle	2.700
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	X-PLOR (3.851)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	3.100
High resolution limit [Å]	2.900	2.900
Rmerge	0.114 *	0.135 *
Total number of observations	27850 *
Number of reflections	9736
Completeness [%]	85.1	51

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion *	6	293	PEG 6000, isopropanol, sodium citrate, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K
1	Vapor diffusion *	6	293	PEG 6000, isopropanol, sodium citrate, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	8 (mg/ml)
2	1	reservoir	PEG6000	16 (%)
3	1	reservoir	isopropanol	18 (%)
4	1	reservoir	sodium citrate	0.1 (M)