5F9K

Dictyostelium discoideum dUTPase at 2.2 Angstrom

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 14-BM-C
Synchrotron site	APS
Beamline	14-BM-C
Temperature [K]	100
Detector technology	CCD
Collection date	2015-11-24
Detector	ADSC QUANTUM 315
Wavelength(s)	0.9787
Spacegroup name	P 21 21 21
Unit cell lengths	71.633, 72.458, 75.158
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.630 - 2.179
R-factor	0.2131
Rwork	0.209
R-free	0.25100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4oop
RMSD bond length	0.011
RMSD bond angle	1.411
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	32.630	2.256
High resolution limit [Å]	2.179	2.179
Rmerge	0.098
Number of reflections	20630
<I/σ(I)>	20.39
Completeness [%]	98.0
Redundancy	5.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	295	ammonium sulfate, magnesium chloride, potassium phosphate, and 2'deoxyuridine 5'-alpha, beta-imido-triphosphate (dUMPNPP)