7RY0

human Hsp90_MC domain structure

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-08-08
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.97914
Spacegroup name	P 21 21 21
Unit cell lengths	38.898, 154.260, 156.750
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.488 - 2.200
R-factor	0.2071
Rwork	0.205
R-free	0.25420
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3q6m
RMSD bond length	0.010
RMSD bond angle	1.302
Data reduction software	HKL-3000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.280
High resolution limit [Å]	2.200	4.740	2.200
Rmerge	0.111	0.050	1.015
Rmeas	0.120	0.055	1.106
Rpim	0.047	0.022	0.435
Total number of observations	317128
Number of reflections	49628	5304	4888
<I/σ(I)>	4.8
Completeness [%]	99.9	99.7	99.7
Redundancy	6.4	6.1	5.9
CC(1/2)		0.999	0.754

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1M Hepes PH 7.5, 20% PEG 400