4EAJ

Co-crystal of AMPK core with AMP soaked 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	P 21 21 2
Unit cell lengths	97.104, 116.006, 48.840
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.609 - 2.609
R-factor	0.2043
Rwork	0.202
R-free	0.25800
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2v92
RMSD bond length	0.005
RMSD bond angle	1.032
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	2.640
High resolution limit [Å]	2.600	2.600
Number of reflections	17204
Completeness [%]	98.7	85.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.26	298	MES pH 6.26, 16% IPP, 1% 1,4-butanediol, VAPOR DIFFUSION, HANGING DROP, temperature 298 K