4WAD

Crystal Structure of TarM with UDP-GlcNAc

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-03-01
Detector	PSI PILATUS 6M
Wavelength(s)	1.00
Spacegroup name	P 63 2 2
Unit cell lengths	124.024, 124.024, 217.030
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	48.132 - 2.800
R-factor	0.2539
Rwork	0.252
R-free	0.29390
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4wac
RMSD bond length	0.004
RMSD bond angle	0.799
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	MOLREP
Refinement software	PHENIX ((phenix.refine: 1.8.4_1496))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000		2.870
High resolution limit [Å]	2.800	12.520	2.800
Rmerge	0.234	0.037	2.263
Rmeas	0.243	0.039	2.355
Total number of observations	326267
Number of reflections	24904	340	1822
<I/σ(I)>	11.69	45.24	1.27
Completeness [%]	99.3	93.9	100
Redundancy	12.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		289	Magnesium-chloride, PEG-8000