7AUS

Yeast Diphosphoinositol Polyphosphate Phosphohydrolase DDP1 in complex with P15

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-07-03
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.979182
Spacegroup name	P 32 2 1
Unit cell lengths	61.670, 61.670, 95.730
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	46.680 - 1.750
R-factor	0.243
Rwork	0.241
R-free	0.27920
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	7aui
RMSD bond length	0.005
RMSD bond angle	1.420
Data reduction software	XDS
Data scaling software	XDS
Phasing software	REFMAC
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.870	1.780
High resolution limit [Å]	1.750	1.750
Rmerge	0.047	0.652
Rpim	0.011	0.149
Number of reflections	21864	1171
<I/σ(I)>	34.3	5
Completeness [%]	100.0	100
Redundancy	18.9	19.8
CC(1/2)	0.998	0.948

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.5	291	16% PEG 3350, 0.1 M Sodium acetate pH 4.5, 0.1 M NaCl, 5 mM Magnesium chloride, 20 mM Sodium fluoride. Protein buffer: 20 mM Tris pH 8.0, 150 mM NaCl, 1 mM DTT, 10 mM Sodium hexametaphosphate.