9FJ1

Structure of the F13 protein of Vaccinia virus in complex with IMCBH

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 2
Synchrotron site	SOLEIL
Beamline	PROXIMA 2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-12-16
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.980112240579
Spacegroup name	F 4 3 2
Unit cell lengths	282.805, 282.805, 282.805
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.130 - 3.800
R-factor	0.2099
Rwork	0.208
R-free	0.24700
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.422
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.21_5207)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.800	4.250
High resolution limit [Å]	3.800	3.800
Number of reflections	10019	2745
<I/σ(I)>	10.1
Completeness [%]	99.7
Redundancy	46
CC(1/2)	0.997	0.430

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	1 M Na3 citrate, 0.1 M Imidazole pH 8 (cryoprotected with 33% glycerol, soaked with 1 mM IMCBH)