7P23

Thaumatin-like protein of Puccinia graminis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, DESY BEAMLINE P11
Synchrotron site	PETRA III, DESY
Beamline	P11
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-04-23
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.03320
Spacegroup name	P 21 21 21
Unit cell lengths	44.140, 77.523, 143.896
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.200 - 1.500
R-factor	0.144
Rwork	0.143
R-free	0.18860
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2ahn
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX (1.18.2_3874)
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	42.200	1.554
High resolution limit [Å]	1.500	1.500
Rmerge	0.140	1.298
Rmeas	0.146
Rpim	0.041	0.367
Number of reflections	79992	7882
<I/σ(I)>	10.34	1.41
Completeness [%]	100.0	99.84
Redundancy	12.9	13.1
CC(1/2)	0.995	0.703

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH	4.5	293	PACT premier F12 (0.2 M Sodium nitrate, 0.1 M Bis-Tris propane pH 6.5, and 20 % w/v PEG 3350)