3EC9

CRYSTAL STRUCTURE OF A NTF2-like protein (BTH_I0051) FROM BURKHOLDERIA THAILANDENSIS E264 AT 1.60 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	2008-08-03
Detector	MARMOSAIC 325 mm CCD
Wavelength(s)	0.91162,0.97932,0.97920
Spacegroup name	P 21 21 21
Unit cell lengths	51.849, 52.021, 111.494
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	27.875 - 1.600
R-factor	0.169
Rwork	0.168
R-free	0.19800
Structure solution method	MAD
RMSD bond length	0.015
RMSD bond angle	1.457
Data reduction software	MOSFLM
Data scaling software	SCALA (3.2.5)
Phasing software	SHELX
Refinement software	REFMAC (5.2.0019)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	27.875	27.880	1.640
High resolution limit [Å]	1.600	7.160	1.600
Rmerge	0.092	0.053	0.498
Total number of observations		1603	10793
Number of reflections	40560
<I/σ(I)>	5.825	10.5	1.5
Completeness [%]	99.9	96.4	99.7
Redundancy	3.6	3.1	3.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	277	0.2000M Ca(OAc)2, 20.0000% PEG-8000, 0.1M MES pH 6.0, NANODROP, VAPOR DIFFUSION, SITTING DROP, temperature 277K