4H1H

Crystal structure of MccF homolog from Listeria monocytogenes EGD-e

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	2012-03-12
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9794
Spacegroup name	P 41 3 2
Unit cell lengths	169.023, 169.023, 169.023
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.000 - 2.460
R-factor	0.20886
Rwork	0.207
R-free	0.25252
Structure solution method	SAD MR
RMSD bond length	0.015
RMSD bond angle	1.505
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	Auto-Rickshaw
Refinement software	REFMAC (5.6.0117)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	2.490
High resolution limit [Å]	2.450	2.450
Rmerge	0.120
Number of reflections	30344
<I/σ(I)>	17.7
Completeness [%]	98.7	99.8
Redundancy	8.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.5	289	1.3 M Ammonium Sulfate, 0.2 Sodium Chloride, Acetate pH 4.5 , VAPOR DIFFUSION, HANGING DROP, temperature 289K