12NZ

Crystal structure of a beta-domain (beta-dom_N1) from GH26 (EiGH26b)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	LNLS SIRIUS BEAMLINE MANACA
Synchrotron site	LNLS SIRIUS
Beamline	MANACA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2025-10-14
Detector	DECTRIS PILATUS 2M
Wavelength(s)	0.977200
Spacegroup name	C 1 2 1
Unit cell lengths	117.328, 67.873, 255.088
Unit cell angles	90.00, 99.31, 90.00

Refinement procedure

Resolution	46.520 - 2.300
R-factor	0.2344
Rwork	0.229
R-free	0.25950
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.475
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.21.2_5419)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	46.520	46.520	2.440
High resolution limit [Å]	2.300	6.830	2.300
Rmerge	0.229	0.061	1.277
Rmeas	0.297	0.077	1.677
Number of reflections	79780	1340	6653
<I/σ(I)>	2.6
Completeness [%]	45.3
Redundancy	5.694
CC(1/2)	0.977	0.994	0.186

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	291	1.4 M Trisodium Citrate, 0.1 M HEPES pH 7.5