3GZ5

Crystal structure of Shewanella oneidensis NrtR

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	OTHER
Collection date	2007-09-27
Spacegroup name	P 32 2 1
Unit cell lengths	75.157, 75.157, 172.511
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	28.320 - 2.200
R-factor	0.22328
Rwork	0.221
R-free	0.27319
Structure solution method	SAD
RMSD bond length	0.013
RMSD bond angle	1.409
Data reduction software	DENZO
Data scaling software	SCALEPACK
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.280
High resolution limit [Å]	2.200	4.740	2.200
Rmerge	0.039	0.022	0.551
Number of reflections	29423
<I/σ(I)>	39.172
Completeness [%]	99.6	98	99.5
Redundancy	4.7	4.7	4.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1