7S9H

Cryogenic Human Hsp90a-NTD bound to EC144

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-1
Synchrotron site	NSLS-II
Beamline	17-ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-06-01
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1
Spacegroup name	I 2 2 2
Unit cell lengths	66.381, 90.196, 97.719
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	53.460 - 1.450
R-factor	0.1577
Rwork	0.157
R-free	0.18410
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1yer
RMSD bond length	0.017
RMSD bond angle	1.350
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]	53.460	1.500
High resolution limit [Å]	1.450	1.450
Rmerge	0.066
Number of reflections	50340	4872
<I/σ(I)>	14.41
Completeness [%]	96.3
Redundancy	7.4
CC(1/2)	0.998	0.927

Crystallization Conditions

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