3NKR

Crystal structure of mouse autotaxin in complex with 22:6-LPA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE AR-NE3A
Synchrotron site	Photon Factory
Beamline	AR-NE3A
Temperature [K]	100
Detector technology	CCD
Collection date	2010-03-16
Detector	ADSC QUANTUM 270
Wavelength(s)	1.000
Spacegroup name	P 1 21 1
Unit cell lengths	61.544, 94.107, 75.308
Unit cell angles	90.00, 95.26, 90.00

Refinement procedure

Resolution	24.886 - 1.704
R-factor	0.1935
Rwork	0.192
R-free	0.21980
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3nkm
RMSD bond length	0.009
RMSD bond angle	1.315
Data reduction software	DENZO
Data scaling software	SCALEPACK
Refinement software	PHENIX (1.6_289)

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	1.700
Number of reflections	92321

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	20-25% PEG 3350, 0.15mM NaCl, 0.5M KSCN, 0.2mM ZnSO4, 1% polyvinylpyrrolidone, 0.2mM 22:6-LPA, VAPOR DIFFUSION, SITTING DROP, temperature 293K