9GYC

Vitamin D receptor in complex with Sila-d

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-09-17
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.98
Spacegroup name	P 65 2 2
Unit cell lengths	65.914, 65.914, 262.944
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	47.830 - 2.200
R-factor	0.1956
Rwork	0.194
R-free	0.24640
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.016
RMSD bond angle	1.558
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]	47.830	2.279
High resolution limit [Å]	2.200	2.200
Number of reflections	18174	1739
<I/σ(I)>	20.4
Completeness [%]	99.2
Redundancy	2
CC(1/2)	0.976	0.982

Crystallization Conditions

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