1P93

CRYSTAL STRUCTURE OF THE AGONIST FORM OF GLUCOCORTICOID RECEPTOR

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-4
Synchrotron site	ESRF
Beamline	ID14-4
Temperature [K]	100
Detector technology	CCD
Collection date	2002-02-21
Detector	ADSC QUANTUM 4
Wavelength(s)	0.93927
Spacegroup name	P 31
Unit cell lengths	127.400, 127.400, 91.800
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	55.170 - 2.700
R-factor	0.35
Rwork	0.345
R-free	0.36300
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1nhz
RMSD bond length	0.012
RMSD bond angle	1.500
Data reduction software	MOSFLM
Data scaling software	CCP4 ((SCALA))
Phasing software	MOLREP
Refinement software	CNX (2002)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	55.000	2.850
High resolution limit [Å]	2.700	2.700
Rmerge	0.103	0.527
Number of reflections	45796
<I/σ(I)>	4	1.7
Completeness [%]	100.0	100
Redundancy	3	3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	281	PEG 400, MgCl2, Dioxane, Tris, pH 8.5, VAPOR DIFFUSION, HANGING DROP