4RB3

Crystal structure of Magnetospirillum gryphiswaldense MSR-1 Fur-Mn2+-feoAB1 operator

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BSRF BEAMLINE 3W1A
Synchrotron site	BSRF
Beamline	3W1A
Temperature [K]	130
Detector technology	CCD
Collection date	2012-12-26
Detector	ADSC QUANTUM 210
Wavelength(s)	1.0
Spacegroup name	C 1 2 1
Unit cell lengths	93.995, 68.642, 83.995
Unit cell angles	90.00, 108.70, 90.00

Refinement procedure

Resolution	44.560 - 2.600
R-factor	0.23411
Rwork	0.232
R-free	0.26485
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4rb2
RMSD bond length	0.005
RMSD bond angle	0.944
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	REFMAC (5.7.0029)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.640
High resolution limit [Å]	2.600	2.600
Number of reflections	15330
Completeness [%]	97.1	85.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	277	pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 277K