2F9H

The Crystal Structure of PTS System IIA Component from Enterococcus faecalis V583

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-BM
Synchrotron site	APS
Beamline	19-BM
Temperature [K]	100
Detector technology	CCD
Collection date	2005-07-25
Detector	SBC-3
Wavelength(s)	0.9793, 0.9795
Spacegroup name	P 32 2 1
Unit cell lengths	58.249, 58.249, 140.443
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	34.320 - 1.570
R-factor	0.169
Rwork	0.169
R-free	0.22900
Structure solution method	MAD
RMSD bond length	0.007
RMSD bond angle	1.500
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	HKL-3000
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	34.320	1.630
High resolution limit [Å]	1.570	1.570
Rmerge	0.054	0.332
Number of reflections	38988
<I/σ(I)>	17.3	4.5
Completeness [%]	98.7	88.4
Redundancy	12.7	8.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.6	291	0.1 M Sodium acetate pH 4.6, 4% PEG4000, VAPOR DIFFUSION, SITTING DROP, temperature 291K
1	VAPOR DIFFUSION, SITTING DROP	4.6	291	0.1 M Sodium acetate pH 4.6, 4% PEG4000, VAPOR DIFFUSION, SITTING DROP, temperature 291K
1	VAPOR DIFFUSION, SITTING DROP	4.6	291	0.1 M Sodium acetate pH 4.6, 4% PEG4000, VAPOR DIFFUSION, SITTING DROP, temperature 291K