6SNV

DNA mismatch repair proteins MLH1 and MLH3

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2012-05-02
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.98011
Spacegroup name	P 21 21 2
Unit cell lengths	90.893, 134.806, 102.569
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.660 - 2.500
R-factor	0.231
Rwork	0.229
R-free	0.27100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4e4w
RMSD bond length	0.008
RMSD bond angle	0.980
Data reduction software	XDS
Data scaling software	XDS
Phasing software	MOLREP
Refinement software	BUSTER (2.10.3)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.660
High resolution limit [Å]	2.500	2.500
Rmerge	0.050	0.779
Rmeas	0.054	0.908
Rpim	0.020	0.457
Number of reflections	30446	1559
<I/σ(I)>	18.56	1.56
Completeness [%]	95.0
Redundancy	6.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	6	293	PEG4000