4XY2

Crystal structure of PDE10A in complex with ASP9436

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]	90
Detector technology	CCD
Collection date	2010-11-01
Detector	ADSC QUANTUM 270
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	50.447, 82.114, 159.150
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	79.570 - 2.030
R-factor	0.20824
Rwork	0.205
R-free	0.25987
RMSD bond length	0.016
RMSD bond angle	1.757
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	AMoRE
Refinement software	REFMAC (5.8.0049)

Data quality characteristics

	Overall
Low resolution limit [Å]	79.570
High resolution limit [Å]	2.030
Number of reflections	36797
<I/σ(I)>	29.3
Completeness [%]	89.2
Redundancy	4.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	298	Bis-tris propane, Magnesium sulfate, PEG3350