7XB5

Structure of the ligand-binding domain of S. cerevisiae Upc2 in fusion with T4 lysozyme

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	110
Detector technology	CCD
Collection date	2015-08-04
Detector	ADSC QUANTUM 270
Wavelength(s)	0.97934
Spacegroup name	C 2 2 21
Unit cell lengths	65.744, 125.085, 155.272
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.980 - 3.440
R-factor	0.2601
Rwork	0.258
R-free	0.30080
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4n9n
RMSD bond length	0.012
RMSD bond angle	1.724
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	3.560
High resolution limit [Å]	3.440	3.500
Rmerge	0.098	0.561
Number of reflections	8514	418
<I/σ(I)>	32.8	4.8
Completeness [%]	97.9	96.5
Redundancy	7.2	7.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	296	0.1 M HEPES pH 7.0, 12.5% PEG 8000, 0.2 M sodium citrate