9EZ2

Vitamin D receptor complex with 1,4b,25-trihydroxyvitamin D3

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 2
Synchrotron site	SOLEIL
Beamline	PROXIMA 2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-07-08
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.98
Spacegroup name	P 65 2 2
Unit cell lengths	66.140, 66.140, 263.740
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	47.990 - 1.800
R-factor	0.2035
Rwork	0.202
R-free	0.23010
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.785
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.990	1.864
High resolution limit [Å]	1.800	1.800
Number of reflections	32871	3184
<I/σ(I)>	23.45
Completeness [%]	99.3
Redundancy	2
CC(1/2)	1.000	0.915

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M MES pH 6.0,2.5 M NaOAc