2YA3

STRUCTURE OF THE REGULATORY FRAGMENT OF MAMMALIAN AMPK IN COMPLEX WITH COUMARIN ADP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	CCD
Collection date	2010-05-10
Detector	ADSC CCD
Spacegroup name	P 21 21 21
Unit cell lengths	48.943, 124.060, 125.315
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 2.510
R-factor	0.22463
Rwork	0.223
R-free	0.26271
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2v8q
RMSD bond length	0.007
RMSD bond angle	1.230
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	REFMAC (5.5.0109)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	28.200	2.600
High resolution limit [Å]	2.500	2.500
Rmerge	0.060	0.260
Number of reflections	25251
<I/σ(I)>	18	4
Completeness [%]	99.2	99.9
Redundancy	3.6	3.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1