5U8G

DNA Polymerase Beta crystallized in PEG 400

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RUH3R
Temperature [K]	104
Detector technology	IMAGE PLATE
Collection date	2013-02-11
Detector	MAR scanner 345 mm plate
Wavelength(s)	1.5418
Spacegroup name	P 1 21 1
Unit cell lengths	54.104, 78.659, 54.721
Unit cell angles	90.00, 104.25, 90.00

Refinement procedure

Resolution	13.680 - 2.166
R-factor	0.1839
Rwork	0.179
R-free	0.22480
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3isb
RMSD bond length	0.002
RMSD bond angle	0.495
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.9_1692))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	14.000	14.000	2.250
High resolution limit [Å]	2.166	4.620	2.166
Rmerge	0.112	0.062	0.622
Number of reflections	45604
<I/σ(I)>	13.7
Completeness [%]	99.8	100	98.1
Redundancy	11.6	14.1	4.3
CC(1/2)		0.999	0.738

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	291	24% PEG 400, 30 mM potassium sodium tartrate, 1% 1,4-dioxane