5GRK

Crystal structure of Uracil DNA glycosylase -Xanthine complex from Bradyrhizobium diazoefficiens

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]	93
Detector technology	CCD
Collection date	2016-02-26
Detector	ADSC QUANTUM 270
Wavelength(s)	0.97934
Spacegroup name	P 21 21 21
Unit cell lengths	70.023, 89.894, 255.339
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.174 - 2.804
R-factor	0.2214
Rwork	0.220
R-free	0.24410
RMSD bond length	0.004
RMSD bond angle	0.819
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.174	2.850
High resolution limit [Å]	2.804	2.800
Number of reflections	40422
<I/σ(I)>	15.13
Completeness [%]	99.9
Redundancy	13.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4	291	20% PEG3350, 200 mM sodium citrate, 100 mM sodium citrate/citric acid