8GQ3

RTT109 mutant from Candida albicans

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	126.15
Detector technology	PIXEL
Collection date	2018-08-03
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.979
Spacegroup name	P 1 21 1
Unit cell lengths	51.249, 69.335, 54.538
Unit cell angles	90.00, 115.17, 90.00

Refinement procedure

Resolution	49.359 - 1.767
R-factor	0.1637
Rwork	0.162
R-free	0.20180
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7bxw
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.15.2_3472)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.820
High resolution limit [Å]	1.767	4.050	1.770
Rmerge	0.111	0.090	0.471
Rmeas	0.119	0.097	0.514
Rpim	0.043	0.035	0.200
Number of reflections	33734	2909	2453
<I/σ(I)>	5.4
Completeness [%]	98.9	99.8	87.1
Redundancy	7.4	7.5	5.8
CC(1/2)		0.992	0.898

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291.15	0.1 M Bis-Tris pH 6.0, 2% Tacsimate pH 6.0 and 15~20% PEG3350