7AZ0

Structure of the mouse 8-oxoguanine DNA Glycosylase mOGG1 in complex with TH12161

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-02-29
Detector	DECTRIS EIGER2 XE 16M
Wavelength(s)	0.9795
Spacegroup name	P 21 21 21
Unit cell lengths	81.086, 81.645, 169.631
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	73.676 - 2.400
Rwork	0.230
R-free	0.25660
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6g3y
RMSD bond length	0.004
RMSD bond angle	1.249
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	81.640	2.490
High resolution limit [Å]	2.400	2.400
Number of reflections	44894	4638
<I/σ(I)>	11.1	1.4
Completeness [%]	100.0	100
Redundancy	26.3
CC(1/2)	0.999	0.640

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		295	0.12 M Alcohols, 0.1 M Buffer System 2 pH 7.5, 30% v/v Precipitant Mix 2 (Morpheus Screen, Molecular Dimensions)