7CE2

The Crystal structure of TeNT Hc complexed with neutralizing antibody

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-06-18
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9796
Spacegroup name	P 21 21 21
Unit cell lengths	59.690, 136.990, 137.370
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.067 - 2.010
R-factor	0.1819
Rwork	0.180
R-free	0.21820
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1a8d
RMSD bond length	0.008
RMSD bond angle	0.969
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.067	2.120
High resolution limit [Å]	2.010	2.010
Number of reflections	75830	75830
<I/σ(I)>	10.7
Completeness [%]	100.0
Redundancy	11
CC(1/2)	0.997	0.996

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		284	3% w/v Dextran sulfate (sodium salt), 0.1M BICINE PH 8.5, 15% w/v PEG 20000