3ELE

Crystal structure of Amino Transferase (RER070207001803) from Eubacterium rectale at 2.10 A resolution

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL9-2
Synchrotron site	SSRL
Beamline	BL9-2
Temperature [K]	100
Detector technology	CCD
Collection date	2008-08-10
Detector	MARMOSAIC 325 mm CCD
Wavelength(s)	0.91837,0.97936,0.97917
Spacegroup name	P 1
Unit cell lengths	65.564, 68.387, 98.112
Unit cell angles	82.51, 79.52, 75.68

Refinement procedure

Resolution	29.881 - 2.100
R-factor	0.175
Rwork	0.173
R-free	0.22200
Structure solution method	MAD
RMSD bond length	0.015
RMSD bond angle	1.618
Data reduction software	MOSFLM
Data scaling software	SCALA (3.2.5)
Phasing software	SHELX
Refinement software	REFMAC (5.2.0019)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	29.881	29.890	2.150
High resolution limit [Å]	2.100	9.390	2.100
Rmerge	0.069	0.037	0.350
Total number of observations		1996	13457
Number of reflections	92103
<I/σ(I)>	9.121	15.8	2.1
Completeness [%]	97.6	95.7	96.7
Redundancy	2	2	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	277	1.0000M LiCl, 20.0000% PEG-6000, 0.1M HEPES pH 7.0, NANODROP, VAPOR DIFFUSION, SITTING DROP, temperature 277K