3ONQ

Crystal Structure of Regulator of Polyketide Synthase Expression BAD_0249 from Bifidobacterium adolescentis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-BM
Synchrotron site	APS
Beamline	19-BM
Temperature [K]	100
Detector technology	CCD
Collection date	2010-08-22
Detector	ADSC QUANTUM 210r
Wavelength(s)	0.97923
Spacegroup name	P 21 21 21
Unit cell lengths	85.452, 93.452, 166.687
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.811 - 2.098
R-factor	0.175
Rwork	0.173
R-free	0.20200
Structure solution method	SAD
RMSD bond length	0.008
RMSD bond angle	1.036
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	HKL-3000
Refinement software	PHENIX ((phenix.refine: 1.6.2_432))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.140
High resolution limit [Å]	2.100	2.100
Number of reflections	78815
<I/σ(I)>	11.4	4
Completeness [%]	100.0	100
Redundancy	7.8	7.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	298	0.1 M Bis-Tris-Propane:NaOH pH 7.0, 1.5 M Ammonium sulphate, VAPOR DIFFUSION, SITTING DROP, temperature 298K