3W0A

Crystal Structure Analysis of Vitamin D receptor

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL32B2
Synchrotron site	SPring-8
Beamline	BL32B2
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2004-02-01
Detector	RIGAKU RAXIS
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	44.619, 51.803, 132.513
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	11.100 - 1.800
R-factor	0.194
Rwork	0.192
R-free	0.23570
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.010
RMSD bond angle	0.940
Data reduction software	MOSFLM
Data scaling software	SCALA (2.7.5)
Refinement software	BUSTER-TNT (BUSTER 2.11.2)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	33.520	33.611	1.590
High resolution limit [Å]	1.507	4.770	1.510
Rmerge	0.059	0.059	0.347
Total number of observations		4886	1170
Number of reflections	33210
<I/σ(I)>	13	23.3	1.5
Completeness [%]	67.5	89.1	12.6
Redundancy	2.7	3.2	1.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP			VAPOR DIFFUSION, HANGING DROP