9YEB

Nickel Pincer Mononucleotide-Dependent NphT

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.3.1
Synchrotron site	ALS
Beamline	8.3.1
Temperature [K]	194
Detector technology	PIXEL
Collection date	2025-06-27
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.11584
Spacegroup name	C 1 2 1
Unit cell lengths	147.597, 49.151, 79.218
Unit cell angles	90.00, 117.34, 90.00

Refinement procedure

Resolution	70.370 - 1.300
R-factor	0.1459
Rwork	0.145
R-free	0.16750
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	1.152
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.21.2_5419)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	70.370	1.310
High resolution limit [Å]	1.300	1.300
Number of reflections	246252	4003
<I/σ(I)>	12.62	1.72
Completeness [%]	99.2
Redundancy	2
CC(1/2)	0.999	0.848

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.5	298	100 mM sodium Acetate pH 4.5, 200 mM ammonium chloride, 25.5% (w/v) PEG 3350