1FOT

STRUCTURE OF THE UNLIGANDED CAMP-DEPENDENT PROTEIN KINASE CATALYTIC SUBUNIT FROM SACCHAROMYCES CEREVISIAE

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X12C
Synchrotron site	NSLS
Beamline	X12C
Temperature [K]	289
Detector technology	DIFFRACTOMETER
Detector	ENRAF-NONIUS FAST
Spacegroup name	P 65 2 2
Unit cell lengths	61.000, 61.000, 322.000
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	20.000 - 2.800
R-factor	0.194
Rwork	0.194
R-free	0.24300
RMSD bond length	0.009
RMSD bond angle	1.600
Data reduction software	MADNESS
Data scaling software	FS
Phasing software	PHASES
Refinement software	CNS (0.5)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	98.000	2.970
High resolution limit [Å]	2.800	2.800
Rmerge	0.083
Total number of observations	86072 *
Number of reflections	7854
Completeness [%]	82.1	52.7
Redundancy	9.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	16 *	Kuret, J., (1991) Biochemistry, 30, 10595. *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	Tris-HCl	20 (mM)
2	1	drop	2-propanol	10 (%)
3	1	drop		10 (mM)