8B1P

Crystal structure of SUDV VP40 CCS mutant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-04-27
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.999998
Spacegroup name	C 1 2 1
Unit cell lengths	63.851, 91.068, 48.381
Unit cell angles	90.00, 96.08, 90.00

Refinement procedure

Resolution	48.110 - 1.700
R-factor	0.1778
Rwork	0.176
R-free	0.20490
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4ld8
RMSD bond length	0.009
RMSD bond angle	1.020
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.110	1.630
High resolution limit [Å]	1.600	1.600
Number of reflections	35310	1709
<I/σ(I)>	19	3.5
Completeness [%]	98.4	95.8
Redundancy	3.8	3.8
CC(1/2)	0.999	0.972

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	Morpheus A7 30% (w/v) GOL_4P4K (glycerol and PEG4000) 0.1 M morpheus buffer 2 (HEPES and MOPS) 60 mM morpheus divalents (MgCl2, CaCl2)