8RM7

Crystal Structure of Human Androgen Receptor DNA Binding Domain Bound to its Response Element: MMTV-177 GRE/ARE

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I24
Synchrotron site	Diamond
Beamline	I24
Temperature [K]	277.15
Detector technology	PIXEL
Collection date	2021-08-10
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.999
Spacegroup name	C 1 2 1
Unit cell lengths	137.910, 29.780, 112.609
Unit cell angles	90.00, 124.91, 90.00

Refinement procedure

Resolution	46.170 - 2.250
R-factor	0.2692
Rwork	0.267
R-free	0.31000
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.760
Data reduction software	xia2 (0.6.0)
Data scaling software	Aimless (0.7.4)
Phasing software	MOLREP (11.7.03)
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.180	2.320
High resolution limit [Å]	2.250	2.250
Rmerge	0.098	0.358
Rmeas	0.108	0.406
Rpim	0.046	0.188
Number of reflections	18435	1686
<I/σ(I)>	8.7	2.7
Completeness [%]	100.0	100
Redundancy	5.4	4.6
CC(1/2)	0.994	0.839

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277.15	0.2 M sodium citrate and 20 %(w/v) PEG 3350