2Z99

Crystal Structure of ScpB from Mycobacterium tuberculosis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 4A
Synchrotron site	PAL/PLS
Beamline	4A
Temperature [K]	100
Detector technology	CCD
Collection date	2006-06-22
Detector	ADSC QUANTUM 210
Wavelength(s)	1.0
Spacegroup name	H 3 2
Unit cell lengths	136.690, 136.690, 78.550
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	47.270 - 2.300
Rwork	0.244
R-free	0.28500
Structure solution method	SAD
RMSD bond length	0.007
RMSD bond angle	1.250
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	SOLVE
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.380
High resolution limit [Å]	2.300	2.300
Number of reflections	12625
<I/σ(I)>	33.9	4.7
Completeness [%]	98.4	97

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	298	2M NaCl, 10% PEG 6000, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K
1	VAPOR DIFFUSION, SITTING DROP	7.5	298	2M NaCl, 10% PEG 6000, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K