7JJN

Eubacterium rectale Amy13B (EUR_01860)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-D
Synchrotron site	APS
Beamline	21-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-11-13
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.979
Spacegroup name	P 1 21 1
Unit cell lengths	84.180, 82.760, 85.860
Unit cell angles	90.00, 92.86, 90.00

Refinement procedure

Resolution	38.070 - 2.250
R-factor	0.1639
Rwork	0.162
R-free	0.19840
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1wza
RMSD bond length	0.006
RMSD bond angle	1.108
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	REFMAC (5.8.0230)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.070	2.330
High resolution limit [Å]	2.250	2.250
Rmerge	0.150	0.840
Rmeas	0.160
Number of reflections	55448	5536
<I/σ(I)>	9.9
Completeness [%]	99.0	99.5
Redundancy	7	7.2
CC(1/2)	0.990	0.770

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		295	0.17M Am Sulfate, 25.5% PEG 4000, 15% glycerol (JCSG+ screen, Molecular Dimensions)