8VVK

CCHFV GP38 bound to ADI-46143 Fab

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	CCD
Collection date	2021-07-15
Detector	ADSC QUANTUM 315
Wavelength(s)	0.979
Spacegroup name	P 61 2 2
Unit cell lengths	149.647, 149.647, 315.727
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	59.950 - 2.610
R-factor	0.1791
Rwork	0.177
R-free	0.21740
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	0.741
Data reduction software	iMOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	59.950	2.703
High resolution limit [Å]	2.610	2.610
Rmerge	0.027	0.262
Rmeas	0.038	0.371
Rpim	0.027	0.262
Number of reflections	64162	6283
<I/σ(I)>	15.64	2.81
Completeness [%]	99.9	99.86
Redundancy	2	2
CC(1/2)	0.999	0.814

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293	0.2 M Ammonium Citrate pH 7.5, 9.3% (w/v) PEG 3350, 12.6% (v/v) 2-Propanol