5HX7

Metal ABC transporter from Listeria monocytogenes

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	2015-12-18
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9792
Spacegroup name	P 21 21 21
Unit cell lengths	65.603, 66.652, 67.783
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	33.400 - 1.750
R-factor	0.1726
Rwork	0.171
R-free	0.20130
Structure solution method	SAD
RMSD bond length	0.011
RMSD bond angle	1.447
Data reduction software	HKL-3000
Data scaling software	HKL-2000
Phasing software	HKL-3000
Refinement software	REFMAC (5.8.0073)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.780
High resolution limit [Å]	1.750	4.750	1.750
Rmerge	0.121	0.070	0.859
Rmeas	0.135	0.079	0.977
Rpim	0.059	0.035	0.454
Total number of observations	160627
Number of reflections	30563
<I/σ(I)>	8.8		2.18
Completeness [%]	99.6	98.2	99.1
Redundancy	5.3	4.8	4.4
CC(1/2)		0.994	0.631

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	289	0.2 M magnesium chloride, 0.1 M Tris buffer, 20% PEG 8000