29OL

X-ray structure of the adduct formed upon reaction of the gold compound AF-Npx with lysozyme (Structure 2)

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-2
Synchrotron site	ESRF
Beamline	ID23-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2025-04-16
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.9677
Spacegroup name	P 43 21 2
Unit cell lengths	78.660, 78.660, 37.327
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.330 - 1.441
Rwork	0.180
R-free	0.19990
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.012
RMSD bond angle	1.812
Data reduction software	autoPROC
Data scaling software	autoPROC
Phasing software	PHASER
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.330	1.510
High resolution limit [Å]	1.440	1.440
Rmerge	0.200
Number of reflections	20064	1003
<I/σ(I)>	12.9	21.8
Completeness [%]	94.4	46.7
Redundancy	22.2	21.8
CC(1/2)	0.994	0.627

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	298	14% PEG 8K, 0.1 M sodium citrate and 0.1 M sodium cacodylate buffer pH 6.5