7SUV

APE1 exonuclease substrate complex with 8oxoG opposite A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-07-10
Detector	DECTRIS PILATUS 200K
Wavelength(s)	1.54
Spacegroup name	P 1 21 1
Unit cell lengths	71.112, 66.486, 91.983
Unit cell angles	90.00, 110.69, 90.00

Refinement procedure

Resolution	24.960 - 1.990
R-factor	0.2274
Rwork	0.226
R-free	0.26490
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5dfi
RMSD bond length	0.008
RMSD bond angle	1.011
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHENIX (1.19.2_4158)
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	25.000	2.030
High resolution limit [Å]	1.990	2.000
Rmeas	0.145	0.674
Rpim	0.063	0.404
Number of reflections	96631	189625
<I/σ(I)>	15.04	1.71
Completeness [%]	98.6	96.9
Redundancy	3.7	2.5
CC(1/2)		0.829

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5	293.15	7 - 14% PEG20000, 100 mM sodium citrate, 15% glycerol, 5 mM calcium chloride