9FNV

Structure of the mouse 8-oxoguanine DNA Glycosylase mOGG1 in complex with ligand TH12163

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	MAX IV BEAMLINE BioMAX
Synchrotron site	MAX IV
Beamline	BioMAX
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-06-06
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0332
Spacegroup name	P 21 21 21
Unit cell lengths	81.390, 81.480, 170.190
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	73.400 - 2.250
Rwork	0.200
R-free	0.25220
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.552
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0411)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	73.400	2.290
High resolution limit [Å]	2.250	2.250
Number of reflections	54738	2676
<I/σ(I)>	15.2
Completeness [%]	100.0
Redundancy	13.4
CC(1/2)	0.999	0.736

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		294	0.12 M Alcohols, 0.1 M imidazole/MES pH 6.5, 50 % EDO_P8K