2DYL

Crystal structure of human mitogen-activated protein kinase kinase 7 activated mutant (S287D, T291D)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE AR-NW12A
Synchrotron site	Photon Factory
Beamline	AR-NW12A
Temperature [K]	100
Detector technology	CCD
Collection date	2006-02-07
Detector	ADSC QUANTUM 210
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	61.552, 69.635, 84.035
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.120 - 2.450
R-factor	0.217
Rwork	0.217
R-free	0.28260
Structure solution method	MIR
Starting model (for MR)	1s9j
RMSD bond length	0.010
RMSD bond angle	1.500
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.540
High resolution limit [Å]	2.450	2.450
Number of reflections	13708
<I/σ(I)>	26.0099	2.95349
Completeness [%]	99.0	97
Redundancy	5.77064

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	300	0.1M Tris, 0.2M ammonium acetate, 25% PEG 3350, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 300K