8TTO

Structure of Hachiman anti-defense 1 (Had1)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.1
Synchrotron site	ALS
Beamline	8.2.1
Temperature [K]	80
Detector technology	CCD
Collection date	2023-06-14
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.00011
Spacegroup name	P 1
Unit cell lengths	30.938, 40.181, 45.291
Unit cell angles	75.22, 89.42, 74.91

Refinement procedure

Resolution	37.450 - 2.000
R-factor	0.2194
Rwork	0.215
R-free	0.25540
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.001
RMSD bond angle	0.400
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.450	2.050
High resolution limit [Å]	2.000	2.000
Number of reflections	13372	979
<I/σ(I)>	4.9
Completeness [%]	97.3
Redundancy	1.8
CC(1/2)	0.993	0.490

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	100 mM MES pH 6.2, 30% PEG 4000