7WW6

Crystal structure of MutT-8-oxo-dGTP complex: Reaction for 20 min in 5 mM Mn2+

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-5A
Synchrotron site	Photon Factory
Beamline	BL-5A
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-06-05
Detector	DECTRIS PILATUS3 S 2M
Wavelength(s)	1
Spacegroup name	P 21 21 21
Unit cell lengths	38.040, 55.900, 59.240
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.660 - 1.360
R-factor	0.1521
Rwork	0.150
R-free	0.18450
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	3a6t
RMSD bond length	0.006
RMSD bond angle	1.214
Data reduction software	XDS
Data scaling software	XDS
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.660	1.400
High resolution limit [Å]	1.360	1.360
Rmerge	0.065	0.623
Number of reflections	27789	27789
<I/σ(I)>	16.8
Completeness [%]	99.9
Redundancy	6.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		288	potassium sodium tartrate, sodium citrate, ammonium sulfate