4EAG

Co-crystal structure of an chimeric AMPK core with ATP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2010-09-14
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.99583
Spacegroup name	C 2 2 21
Unit cell lengths	108.668, 151.283, 109.323
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.861 - 2.701
R-factor	0.2106
Rwork	0.208
R-free	0.25210
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2v8q
RMSD bond length	0.009
RMSD bond angle	1.348
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.5_2)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.750
High resolution limit [Å]	2.700	2.700
Number of reflections	19457
Completeness [%]	77.5	15.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.02	298	MES, 12% Methanol, 2% 1,4-butanodiol, pH 6.02 , VAPOR DIFFUSION, HANGING DROP, temperature 298K