5LDB

Crystal Structure of Polyphosphate Kinase from Meiothermus ruber bound to ADP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-11-14
Detector	DECTRIS PILATUS 2M
Wavelength(s)	1.000010
Spacegroup name	P 43 21 2
Unit cell lengths	165.619, 165.619, 95.150
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.750 - 2.300
R-factor	0.179
Rwork	0.177
R-free	0.21000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5lc9
RMSD bond length	0.010
RMSD bond angle	1.000
Data scaling software	Aimless (0.5.25)
Phasing software	MOLREP
Refinement software	BUSTER-TNT (2.10.3)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.750	2.360
High resolution limit [Å]	2.300	2.300
Rmerge	0.470	4.798
Number of reflections	59190
<I/σ(I)>	10.3	1.1
Completeness [%]	100.0	100
Redundancy	27	28.2
CC(1/2)	0.997

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	298	PEG3350, Li2SO4