6NOI

Crystal structure of Tsn15 in apo form

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-09-16
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9795
Spacegroup name	C 1 2 1
Unit cell lengths	128.838, 36.938, 91.815
Unit cell angles	90.00, 107.54, 90.00

Refinement procedure

Resolution	29.699 - 1.800
R-factor	0.1571
Rwork	0.156
R-free	0.18640
Structure solution method	SAD
RMSD bond length	0.006
RMSD bond angle	0.885
Data reduction software	XDS
Data scaling software	Aimless (0.5.27)
Phasing software	AutoSol
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	29.700	29.700	1.840
High resolution limit [Å]	1.800	9.000	1.800
Rmerge	0.063	0.052	0.218
Rmeas	0.068	0.056	0.253
Rpim	0.027	0.022	0.125
Total number of observations	239481	1982	7862
Number of reflections	38365	341	2014
<I/σ(I)>	22.7	40.6	6.4
Completeness [%]	99.0	96.8	88.7
Redundancy	6.2	5.8	3.9
CC(1/2)	0.998	0.998	0.949

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291.15	0.1 M PCTP pH 6, 25% PEG 1500 buffer