3MYV

Crystal structure of a SusD superfamily protein (BVU_0732) from Bacteroides vulgatus ATCC 8482 at 1.80 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	2009-11-06
Detector	MARMOSAIC 325 mm CCD
Wavelength(s)	0.91837,0.97954,0.97934
Spacegroup name	P 21 21 21
Unit cell lengths	55.136, 83.639, 223.303
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	74.434 - 1.800
R-factor	0.153
Rwork	0.151
R-free	0.19000
Structure solution method	MAD
RMSD bond length	0.013
RMSD bond angle	1.272
Data reduction software	MOSFLM
Data scaling software	SCALA (3.3.15)
Phasing software	SOLVE
Refinement software	REFMAC (5.5.0109)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	74.434	74.430	1.900
High resolution limit [Å]	1.800	5.690	1.800
Rmerge		0.063	0.590
Total number of observations		11478	51786
Number of reflections	96603
<I/σ(I)>	6.4	13.4	1.9
Completeness [%]	99.9	97.8	99.9
Redundancy	3.7	3.5	3.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.7	277	22.5000% polyethylene glycol 3350, 0.2000M di-sodium hydrogen phosphate, 0.1M HEPES pH 6.7, NANODROP, VAPOR DIFFUSION, SITTING DROP, temperature 277K