7S98

Cryogenic Human Hsp90a-NTD bound to N6M

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	PIXEL
Collection date	2020-09-01
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1
Spacegroup name	I 2 2 2
Unit cell lengths	65.827, 89.842, 101.695
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	55.260 - 1.900
R-factor	0.1885
Rwork	0.186
R-free	0.21620
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1yer
RMSD bond length	0.013
RMSD bond angle	1.008
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.19rc5_4047)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	55.260	1.970
High resolution limit [Å]	1.900	1.900
Rmerge	0.107
Number of reflections	24092	2313
<I/σ(I)>	9.12
Completeness [%]	96.2
Redundancy	9.8
CC(1/2)	0.998	0.549

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	1.8 M Malic acid, pH 7