5I4J

Dps4 from Nostoc punctiforme in complex with Zn ions

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-02-23
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.97240
Spacegroup name	P 63
Unit cell lengths	100.920, 100.920, 144.270
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	47.631 - 2.394
R-factor	0.171
Rwork	0.169
R-free	0.21410
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5hjf
RMSD bond length	0.008
RMSD bond angle	1.084
Data scaling software	Aimless (0.5.2)
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	48.090	48.090	2.480
High resolution limit [Å]	2.390	9.270	2.390
Rmerge	0.123	0.034	1.681
Rmeas	0.131
Rpim	0.045
Total number of observations	277574
Number of reflections	32761
<I/σ(I)>	13.9
Completeness [%]	99.8	99.4	98.5
Redundancy	8.5	7.9	8.5
CC(1/2)	0.997

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	291	25% SOKALAN HP 66, 0.1M HEPES pH 7.0 and 0.2M NaOAc,