5UC3

Structure of the dominant negative mutant Glucocorticoid Receptor alpha (L733K/N734P) complexed with RU-486

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2015-07-24
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	1.0
Spacegroup name	C 1 2 1
Unit cell lengths	136.749, 88.320, 64.672
Unit cell angles	90.00, 110.84, 90.00

Refinement procedure

Resolution	20.024 - 2.009
R-factor	0.1796
Rwork	0.178
R-free	0.21180
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1M2Z with C-terminus 50 aa truncation
RMSD bond length	0.006
RMSD bond angle	0.788
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000
High resolution limit [Å]	2.000
Rmerge	0.051	0.494
Number of reflections	47639
<I/σ(I)>	32.9
Completeness [%]	99.6
Redundancy	3.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M HEPES, 0.1 M sodium citrate, 15 % MPD (v/v)