3OGU

DNA Polymerase beta mutant 5P20 complexed with 6bp of DNA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2008-09-26
Detector	PSI PILATUS 6M
Wavelength(s)	1.0000
Spacegroup name	P 21 21 2
Unit cell lengths	175.474, 56.782, 47.602
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.670 - 1.845
R-factor	0.1988
Rwork	0.197
R-free	0.23250
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	9icw
RMSD bond length	0.002
RMSD bond angle	0.636
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX (1.6.1_357)
Refinement software	PHENIX ((phenix.refine: 1.6.1_357))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.677	1.960
High resolution limit [Å]	1.845	1.850
Rmerge	0.065	1.071
<I/σ(I)>	16.1	1.43
Completeness [%]	99.0	92.4
Redundancy	6.2	4.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.3	291	10% PEG 3350, 0.1 M sodium chloride, 0.1 M MES, pH 6.3, VAPOR DIFFUSION, HANGING DROP, temperature 291K