2HYF

The Structure of apo-MntR from Bacillus subtilis, selenomethionine derivative

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.1
Synchrotron site	ALS
Beamline	8.2.1
Temperature [K]	100
Detector technology	CCD
Collection date	2003-11-26
Detector	ADSC QUANTUM 210
Wavelength(s)	0.9793,0.9796,0.9641
Spacegroup name	P 21 21 21
Unit cell lengths	55.890, 65.030, 186.970
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	20.000 - 2.800
Rwork	0.217
R-free	0.27700
Structure solution method	MAD
RMSD bond length	0.008
RMSD bond angle	1.200
Data reduction software	MOSFLM
Data scaling software	CCP4 ((SCALA))
Phasing software	CNS
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	64.600	2.950
High resolution limit [Å]	2.800	2.800
Rmerge	0.106	0.383
Number of reflections	16290
<I/σ(I)>	6.3	2
Completeness [%]	93.6	79.5
Redundancy	4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293	15% PEG 400, 0.2 M ammonium sulfate, 5 mM cobalt(II) chloride, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K