1J6Z

UNCOMPLEXED ACTIN

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 14-BM-C
Synchrotron site	APS
Beamline	14-BM-C
Temperature [K]	100
Detector technology	CCD
Collection date	2000-12-07
Detector	ADSC QUANTUM 4
Wavelength(s)	1
Spacegroup name	C 1 2 1
Unit cell lengths	112.808, 37.498, 85.261
Unit cell angles	90.00, 108.26, 90.00

Refinement procedure

Resolution	20.000 * - 1.540
R-factor	0.179
Rwork	0.179
R-free	0.22300
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1ATN.PDB
RMSD bond length	0.012
RMSD bond angle	25.000 *
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	AMoRE
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	82.000	1.610
High resolution limit [Å]	1.540	1.540
Rmerge	0.061	0.308
Number of reflections	48139
<I/σ(I)>	23.3
Completeness [%]	97.0 *	94.2
Redundancy	7.6	5.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	20 *	PEG 2000 MONOMETHYLETHER 22%, CALCIUM ACETATE 200mM, TRIS 10mM (pH 7), pH 7.00, VAPOR DIFFUSION, HANGING DROP, temperature 293K
1	VAPOR DIFFUSION, HANGING DROP	7	20 *	PEG 2000 MONOMETHYLETHER 22%, CALCIUM ACETATE 200mM, TRIS 10mM (pH 7), pH 7.00, VAPOR DIFFUSION, HANGING DROP, temperature 293K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	6 (mg/ml)
2	1	reservoir	PEG2000 MME	22 (%)
3	1	reservoir	Tris	10 (mM)	pH7.0
4	1	reservoir	calcium acetate	200 (mM)