1H8F

Glycogen Synthase Kinase 3 beta.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SRS BEAMLINE PX14.2
Synchrotron site	SRS
Beamline	PX14.2
Temperature [K]	100
Detector technology	CCD
Collection date	2000-09-15
Detector	ADSC CCD
Spacegroup name	P 21 21 21
Unit cell lengths	83.199, 86.060, 178.093
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.000 * - 2.800
R-factor	0.22
Rwork	0.220
R-free	0.25400 *
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1pme
RMSD bond length	0.008
RMSD bond angle	22.700 *
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	AMoRE
Refinement software	CNS (1.0)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	35.000	2.900
High resolution limit [Å]	2.750	2.750
Rmerge	0.074 *	0.323 *
Number of reflections	33985 *	4883 *
<I/σ(I)>	8.4	2.3
Completeness [%]	99.9	99.9 *
Redundancy	5.6	5.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.2 *		CRYSTAL WERE GROWN BY THE HANGING DROP METHOD. 1UL OF PROTEIN SOLUTION (4MG/ML IN 20MM HEPES-NAOH, 500MM NACL, 2MM MGCL2, 1MM DTT, PH 7.2) WAS MIXED WITH 1UL PRECIPITANT (6% PEG8000, 100MM TRIS-HCL, PH 7.5)

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	1	protein	4 (mg/ml)
2	1	1	HEPES-NaOH	20 (mM)
3	1	1		500 (mM)
4	1	1		2 (mM)
5	1	1	dithiothreitol	1 (mM)	pH7.2
6	1	2	PEG8000	6 (%)
7	1	2	Tris-HCl	100 (mM)	pH7.5