4YJW

Crystal structure of a DUF3829 family protein (BVU_3067) from Bacteroides vulgatus ATCC 8482 at 1.80 A resolution

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL14-1
Synchrotron site	SSRL
Beamline	BL14-1
Temperature [K]	100
Detector technology	CCD
Collection date	2015-02-04
Detector	MARMOSAIC 325 mm CCD
Wavelength(s)	0.9792
Spacegroup name	P 41 21 2
Unit cell lengths	70.766, 70.766, 67.473
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.652 - 1.800
R-factor	0.1743
Rwork	0.173
R-free	0.19470
Structure solution method	SAD
RMSD bond length	0.010
RMSD bond angle	0.840
Data scaling software	XDS (November 3, 2014 BUILT=20141118)
Phasing software	SHELX
Refinement software	BUSTER-TNT (2.10.2)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	28.652	28.652	1.860
High resolution limit [Å]	1.800	3.870	1.800
Rmerge	0.080	0.031	0.739
Rmeas	0.088	0.034	0.843
Total number of observations	187648
Number of reflections	16483	3073	2858
<I/σ(I)>	16.13	47	1.9
Completeness [%]	100.0	99.6	100
Redundancy	6.17

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	9	277	2.40M ammonium sulfate, 0.1M Bicine pH 9.0