5GHI

Crystal structure of human MTH1(G2K mutant) in complex with 8-oxo-dGTP

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	2014-06-06
Detector	DECTRIS PILATUS 2M
Wavelength(s)	1.1
Spacegroup name	P 21 21 21
Unit cell lengths	46.458, 47.554, 123.815
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.096 - 1.211
R-factor	0.1377
Rwork	0.136
R-free	0.17180
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	1.123
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.230
High resolution limit [Å]	1.210	1.210
Rmerge	0.053
Number of reflections	84388
<I/σ(I)>	33.7
Completeness [%]	100.0
Redundancy	6.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	293	sodium citrate, sodium cacodylate, NaCl