5KK1

Structure of pNOB8 AspA-DNA complex.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E+ SUPERBRIGHT
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2012-12-11
Detector	RIGAKU RAXIS IV
Wavelength(s)	1.5418
Spacegroup name	C 1 2 1
Unit cell lengths	148.516, 55.927, 99.964
Unit cell angles	90.00, 109.53, 90.00

Refinement procedure

Resolution	51.935 - 3.380
R-factor	0.2186
Rwork	0.216
R-free	0.24550
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5k5q
RMSD bond length	0.005
RMSD bond angle	0.724
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	PHENIX (1.6.4_486)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	51.935	3.560
High resolution limit [Å]	3.380	3.380
Rmerge	0.071	0.111
Number of reflections	9960
<I/σ(I)>	9.9	4.4
Completeness [%]	90.0	84.4
Redundancy	2.5	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	298	30% PEG 550, MES pH 6.5