3F0H

Crystal structure of Aminotransferase (RER070207000802) from Eubacterium rectale at 1.70 A resolution

Experimental procedure

Experimental method	MAD
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	2008-10-11
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	0.94645,0.97966
Spacegroup name	P 61 2 2
Unit cell lengths	62.450, 62.450, 373.590
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	29.617 - 1.700
R-factor	0.148
Rwork	0.147
R-free	0.16700
Structure solution method	MAD
RMSD bond length	0.015
RMSD bond angle	1.430
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	SHELX
Refinement software	REFMAC (5.5.0053)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	29.617	29.620	1.760
High resolution limit [Å]	1.700	3.660	1.700
Rmerge	0.110	0.058	1.292
Number of reflections	49360	9063	8745
<I/σ(I)>	13.56	36	1.79
Completeness [%]	99.6	99.6	98.3
Redundancy	20.28

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	9	277	20.0000% PEG-6000, 0.1M Bicine pH 9.0, NANODROP, VAPOR DIFFUSION, SITTING DROP, temperature 277K