7X9O

Crystal structure of MutT-8-oxo-dGMP complex with Mg2+ ions: Reaction using Mg2+

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-1A
Synchrotron site	Photon Factory
Beamline	BL-1A
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-02-14
Detector	DECTRIS PILATUS 2M
Wavelength(s)	1.1
Spacegroup name	P 21 21 21
Unit cell lengths	38.449, 56.014, 59.126
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.660 - 1.580
R-factor	0.1677
Rwork	0.167
R-free	0.18870
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	3a6t
RMSD bond length	0.006
RMSD bond angle	1.210
Data reduction software	HKL-2000
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.660	1.610
High resolution limit [Å]	1.580	1.580
Rmerge	0.087	0.443
Number of reflections	17461	792
<I/σ(I)>	13.1
Completeness [%]	96.2
Redundancy	4.7

Crystallization Conditions

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