6NWS

RORgamma Ligand Binding Domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-12-14
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	1.000
Spacegroup name	P 41 21 2
Unit cell lengths	60.805, 60.805, 160.650
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	56.868 - 2.440
R-factor	0.2528
Rwork	0.250
R-free	0.29740
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5vb3
RMSD bond length	0.003
RMSD bond angle	0.535
Data reduction software	XDS
Data scaling software	xia2
Phasing software	PHENIX
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	56.870	56.870
High resolution limit [Å]	2.440	2.440
Number of reflections	11958
<I/σ(I)>	9.21
Completeness [%]	99.1
Redundancy	16

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.4	295	0.1 M sodium phosphate, pH 7.4, 0.5-0.7 M sodium chloride, 4-6% PEG4000, 3% DMSO