3L4M

Crystal Structure of the MauG/pre-Methylamine Dehydrogenase Complex.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-B
Synchrotron site	APS
Beamline	23-ID-B
Temperature [K]	100
Detector technology	CCD
Collection date	2008-11-25
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	1.02665
Spacegroup name	P 1
Unit cell lengths	55.527, 83.524, 107.782
Unit cell angles	109.94, 91.54, 105.78

Refinement procedure

Resolution	44.490 - 2.020
R-factor	0.138
Rwork	0.135
R-free	0.18900
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1mda 1iqc
RMSD bond length	0.023
RMSD bond angle	2.020
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.080
High resolution limit [Å]	2.010	2.010
Rmerge	0.067	0.176
Number of reflections	105427
<I/σ(I)>	10.74	4.3
Completeness [%]	93.1	68.6
Redundancy	2.3	1.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.4	293	0.1M MES pH 6.4, 0.1M sodium acetate, 24-30 % w/v PEG 8000, vapor diffusion, hanging drop, temperature 293K