5MP4

The structure of Pst2p from Saccharomyces cerevisiae

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	2014-05-09
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.972
Spacegroup name	P 21 21 21
Unit cell lengths	69.410, 110.560, 223.810
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.170 - 2.790
R-factor	0.2549
Rwork	0.253
R-free	0.28550
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3b6i
RMSD bond length	0.003
RMSD bond angle	0.565
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.170	2.890
High resolution limit [Å]	2.790	2.790
Rmerge	0.104	0.834
Number of reflections	43021
<I/σ(I)>	10.2	1.8
Completeness [%]	98.1	94.46
Redundancy	4.8	4.7
CC(1/2)	0.998	0.663

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	BATCH MODE	7.5	293	0.1 M HEPES pH 7.5, 25% w/v PEG-3350