8I18

Crystal structure of human MTH1(G2K mutant) in complex with 8-oxo-dGTP at pH 7.7

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL41XU
Synchrotron site	SPring-8
Beamline	BL41XU
Temperature [K]	100
Detector technology	CCD
Collection date	2011-01-29
Detector	RAYONIX MX-225
Wavelength(s)	1
Spacegroup name	P 21 21 21
Unit cell lengths	46.442, 47.754, 124.159
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	33.290 - 1.100
R-factor	0.1461
Rwork	0.145
R-free	0.16930
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.010
RMSD bond angle	1.375
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	33.290	1.140
High resolution limit [Å]	1.100	1.100
Rmerge	0.062	0.232
Number of reflections	110402	9630
<I/σ(I)>	58.8
Completeness [%]	98.0
Redundancy	7.8

Crystallization Conditions

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