9MFJ

Zn-MAHF-9 A8S Metal Alpha-Helix Framework

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	MAX IV BEAMLINE BioMAX
Synchrotron site	MAX IV
Beamline	BioMAX
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-10-20
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.688797
Spacegroup name	P 1 21 1
Unit cell lengths	19.273, 16.128, 24.966
Unit cell angles	90.00, 110.48, 90.00

Refinement procedure

Resolution	18.060 - 0.880
R-factor	0.0862
Rwork	0.086
R-free	0.08810
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	1.289
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.21.2_5419)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	18.060	0.911
High resolution limit [Å]	0.880	0.880
Number of reflections	11554	1126
<I/σ(I)>	18.65
Completeness [%]	99.2
Redundancy	5.3
CC(1/2)	0.997	0.982

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	SLOW COOLING		298	water, acetonitrile, sodium hydroxide, zinc chloride