5VB7

X-ray co-structure of nuclear receptor ROR-gammat Ligand Binding Domain with an agonist and SRC2 peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2011-11-03
Detector	PSI PILATUS 6M
Wavelength(s)	1.0
Spacegroup name	P 41 21 2
Unit cell lengths	62.959, 62.959, 155.322
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.623 - 2.335
R-factor	0.1852
Rwork	0.184
R-free	0.21610
RMSD bond length	0.005
RMSD bond angle	0.600
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.8.2_1309)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	77.660	2.342
High resolution limit [Å]	2.335	2.335
Rmerge	0.114	1.903
Number of reflections	14031
<I/σ(I)>	18.9	2.4
Completeness [%]	100.0	100
Redundancy	12.5	13.3
CC(1/2)	1.000	0.900

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	298	PEG 4000 (2-8%), NACL 0.5M, PIPES (0.1M)