4KKE

The crystal structure of AMP-bound JNK3

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	CCD
Collection date	2012-06-21
Detector	ADSC QUANTUM 315
Wavelength(s)	0.97951
Spacegroup name	P 21 21 21
Unit cell lengths	51.979, 71.311, 107.631
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.850 - 2.200
R-factor	0.23293
Rwork	0.230
R-free	0.29086
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	1.157
Refinement software	REFMAC (5.7.0032)

Data quality characteristics

	Overall
Low resolution limit [Å]	46.850
High resolution limit [Å]	2.000
Number of reflections	19776

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.25	277	16% PEG MME 550, 10% Ethylene glycol, 0.1 M Hepes, 10 mM TCEP, pH 7.25, VAPOR DIFFUSION, HANGING DROP, temperature 277K