8TMW

HTLV-1 capsid protein N-terminal domain triclinic crystal form with sulphate ion

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX1
Synchrotron site	Australian Synchrotron
Beamline	MX1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-04-01
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.9537
Spacegroup name	P 1
Unit cell lengths	28.659, 30.604, 36.388
Unit cell angles	65.62, 70.73, 72.03

Refinement procedure

Resolution	32.220 - 1.710
R-factor	0.2042
Rwork	0.200
R-free	0.24720
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	8ere
RMSD bond length	0.003
RMSD bond angle	0.547
Data reduction software	XDS
Data scaling software	Aimless (0.7.4)
Phasing software	PHASER (2.8.3)
Refinement software	PHENIX (1.20.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	32.220	1.740
High resolution limit [Å]	1.710	1.710
Rmerge	0.050	1.571
Rmeas	0.059	1.861
Rpim	0.031	0.986
Total number of observations	37131	1521
Number of reflections	10396	475
<I/σ(I)>	10.2	0.5
Completeness [%]	91.6
Redundancy	3.6	3.2
CC(1/2)	0.999	0.378

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293	10% ethylene glycol, 10% PEG 8K, 0.1 M HEPES, pH7.5