7KLE

Ternary structure of Dpo4 bound to N7mG in the template base paired with incoming dCTP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.3
Synchrotron site	ALS
Beamline	5.0.3
Temperature [K]	100
Detector technology	CCD
Collection date	2015-03-15
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97648
Spacegroup name	P 21 21 2
Unit cell lengths	99.650, 102.472, 53.034
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.563 - 3.003
R-factor	0.232
Rwork	0.229
R-free	0.28760
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3qz7
RMSD bond length	0.002
RMSD bond angle	0.569
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	20.000	10.000	3.050
High resolution limit [Å]	3.000	7.980	3.000
Rmerge	0.167	0.055	0.991
Total number of observations	79435
Number of reflections	11345	634	565
<I/σ(I)>	4.5
Completeness [%]	100.0	99.8	100
Redundancy	7	6.5	7.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	12 to 18% PEG 3350, 100 mM HEPES (pH 6.6), 100 mM calcicum acetate, and 2.5% glycerol