3DI5

Crystal structure of a dinb-like protein (bce_4655) from bacillus cereus atcc 10987 at 2.01 A resolution

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL11-1
Synchrotron site	SSRL
Beamline	BL11-1
Temperature [K]	100
Detector technology	CCD
Collection date	2008-04-10
Detector	MARMOSAIC 325 mm CCD
Wavelength(s)	0.91837,0.97916,0.97860
Spacegroup name	C 2 2 21
Unit cell lengths	78.120, 84.190, 50.320
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.630 - 2.009
R-factor	0.231
Rwork	0.229
R-free	0.26600
Structure solution method	MAD
RMSD bond length	0.014
RMSD bond angle	1.273
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	SHELX
Refinement software	REFMAC (5.2.0019)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	28.630	28.630	2.070
High resolution limit [Å]	2.009	4.300	2.000
Rmerge	0.034	0.021	0.413
Number of reflections	11180	2093	1627
<I/σ(I)>	13.57	32.1	2.63
Completeness [%]	95.6	95.7	77.6
Redundancy	3.93

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.57	293	0.2M magnesium chloride, 30.5% polyethylene glycol 4000, 0.1M TRIS pH 8.57, NANODROP, VAPOR DIFFUSION, SITTING DROP, temperature 293K