5KTE

Crystal structure of Deinococcus radiodurans MntH, an Nramp-family transition metal transporter

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	177
Detector technology	CCD
Collection date	2011-02-24
Detector	ADSC QUANTUM 315
Wavelength(s)	1.139
Spacegroup name	I 2 2 2
Unit cell lengths	113.131, 132.077, 220.995
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.471 - 3.941
R-factor	0.2722
Rwork	0.268
R-free	0.31310
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4WGW
RMSD bond length	0.003
RMSD bond angle	0.740
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.10_2155)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.471	4.080
High resolution limit [Å]	3.941	3.940
Rmerge	0.171
Number of reflections	11791
<I/σ(I)>	6	0.61
Completeness [%]	95.0	96
Redundancy	16.6	11.4
CC(1/2)	0.990	0.189

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	4.5	277	0.1 M sodium acetate pH 4.5, 0.05 M magnesium acetate, 24% PEG400 and 0.4-1 % beta-octylglucoside
2	VAPOR DIFFUSION	4.5	277	0.1 M sodium acetate pH 4.5, 0.05 M magnesium acetate, 24% PEG400 and 0.4-1 % beta-octylglucoside
3	VAPOR DIFFUSION	4.5	277	0.1 M sodium acetate pH 4.5, 0.05 M magnesium acetate, 24% PEG400 and 0.4-1 % beta-octylglucoside