7AUO

Yeast Diphosphoinositol Polyphosphate Phosphohydrolase DDP1 in complex with PA-InsP8

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	2019-02-28
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.979260
Spacegroup name	P 32 2 1
Unit cell lengths	61.674, 61.674, 89.219
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	45.870 - 2.650
R-factor	0.2359
Rwork	0.234
R-free	0.27150
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7aui
RMSD bond length	0.005
RMSD bond angle	1.348
Data reduction software	XDS
Data scaling software	XDS
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.870	2.780
High resolution limit [Å]	2.650	2.650
Rmerge	0.058	0.650
Rpim	0.014	0.152
Number of reflections	6055	799
<I/σ(I)>	25.1	5.3
Completeness [%]	99.8	99.7
Redundancy	18	19.1
CC(1/2)	1.000	0.972

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5	291	25% PEG 6000, 0.1 M Sodium acetate pH 5.0, 0.1 M NaCl. Protein:precipitant ratio 2:1. Protein buffer: 20 mM Tris pH 8.0, 150 mM NaCl, 1 mM DTT, 10 mM PA-InsP8.