7XVA

Crystal structure of the Human TR4 Ligand Binding Domain in complex with the JAZF1 corepressor fragment

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL02U1
Synchrotron site	SSRF
Beamline	BL02U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-10-07
Detector	DECTRIS PILATUS 2M
Wavelength(s)	0.9793
Spacegroup name	P 43 2 2
Unit cell lengths	76.851, 76.851, 98.365
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.090 - 1.856
Rwork	0.197
R-free	0.21870
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3p0u
RMSD bond length	0.010
RMSD bond angle	1.583
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	BALBES
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.900
High resolution limit [Å]	1.856	1.856
Number of reflections	25132	22758
<I/σ(I)>	36
Completeness [%]	98.0
Redundancy	9.5
CC(1/2)	0.998	0.996

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	HEPES, ammonium sulfate, sodium acetate, MPD