5DVB

Crystal Structure of S. cerevisiae TSA2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-02-15
Detector	PSI PILATUS 6M
Wavelength(s)	0.9786
Spacegroup name	P 21 21 2
Unit cell lengths	171.530, 216.130, 64.490
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.716 - 2.200
R-factor	0.1877
Rwork	0.187
R-free	0.23270
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3sbc
RMSD bond length	0.015
RMSD bond angle	1.435
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX ((1.10_2152: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	42.880		2.250
High resolution limit [Å]	2.200	40.000	2.200
Rmerge	0.166	0.854	4.961
Rmeas	0.166	0.891	4.994
Total number of observations	15148713
Number of reflections	122589	13	7902
<I/σ(I)>	33.67	5.64	1.11
Completeness [%]	100.0	39.4	100
Redundancy	124

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	293	6% (v/v) Tacsimate pH 8 and 16% (w/v) PEG3350