7P22

Thaumatin-like protein of Amycolatopsis rifamycinica

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE MASSIF-1
Synchrotron site	ESRF
Beamline	MASSIF-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-02-17
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.96600
Spacegroup name	P 41 21 2
Unit cell lengths	80.341, 80.341, 169.889
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.290 - 1.870
R-factor	0.1828
Rwork	0.181
R-free	0.20650
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]	46.290	1.937
High resolution limit [Å]	1.870	1.870
Rmerge	0.132	1.127
Rmeas	0.143
Rpim	0.055	0.467
Number of reflections	46839	4587
<I/σ(I)>	11.35
Completeness [%]	99.9	99.91
Redundancy	6.6	6.7
CC(1/2)	0.997	0.648

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH	4.5	293	JCSG+ D1 condition (0.2 M Magnesium chloride hexahydrate, 0.1 M Sodium HEPES pH 7.0 and 30 % v/v PEG 400)