9GYA

Vitamin D Receptor in complex with Sila-e

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	2022-07-16
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.98
Spacegroup name	P 65 2 2
Unit cell lengths	65.920, 65.920, 263.570
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	23.300 - 1.850
R-factor	0.1907
Rwork	0.188
R-free	0.23200
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.838
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX ((1.17_3644: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	23.300	1.916
High resolution limit [Å]	1.850	1.850
Number of reflections	30115	2867
<I/σ(I)>	20.78
Completeness [%]	98.8
Redundancy	2
CC(1/2)	1.000	0.904

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	NaAcetate 2.5M, Hepes 0.1M pH 7.5