4ONR

Crystal structure of Borrelia burgdorferi decorin-binding protein DbpA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2004-02-13
Detector	SBC-3
Wavelength(s)	0.97935
Spacegroup name	P 43
Unit cell lengths	49.524, 49.524, 57.943
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	22.770 - 1.600
R-factor	0.1711
Rwork	0.169
R-free	0.20100
Structure solution method	MAD
RMSD bond length	0.010
RMSD bond angle	1.135
Data reduction software	HKL-3000
Data scaling software	SCALEPACK
Phasing software	MLPHARE
Refinement software	PHENIX (1.8.4_1496)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	22.800	22.800	1.640
High resolution limit [Å]	1.600	3.950	1.600
Rmerge	0.050		0.631
Number of reflections	18358
<I/σ(I)>	33.9		1.7
Completeness [%]	98.8	97.8	87.9
Redundancy	7.5		3.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	9.5	293	0.1 M CHES, 0.05 M NaCl, 30% PEG 3000, 10% (w/v) ethylene glycol, pH 9.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
1	VAPOR DIFFUSION, HANGING DROP	9.5	293	0.1 M CHES, 0.05 M NaCl, 30% PEG 3000, 10% (w/v) ethylene glycol, pH 9.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K