4UB3

DNA polymerase beta closed product complex with a templating cytosine and 8-oxodGMP, 60 s

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	100
Detector technology	CCD
Collection date	2013-07-03
Detector	RIGAKU SATURN 944
Wavelength(s)	1.54
Spacegroup name	P 1 21 1
Unit cell lengths	50.698, 80.094, 55.358
Unit cell angles	90.00, 107.80, 90.00

Refinement procedure

Resolution	21.343 - 2.060
R-factor	0.2171
Rwork	0.214
R-free	0.27440
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2fms
RMSD bond length	0.014
RMSD bond angle	1.073
Refinement software	PHENIX ((phenix.refine: 1.7_650))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.130
High resolution limit [Å]	2.060	2.060
Rmerge	0.083	0.511
Number of reflections	27186
<I/σ(I)>	16.3	2.1
Completeness [%]	97.4	91.2
Redundancy	4.7	3.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	291	50 mM imidazole, 350 mM sodium chloride, 17% PEG3350, pH 8.0