9FQB

crystal structure of ClY21-HNP1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P14 (MX2)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P14 (MX2)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-02-29
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97625
Spacegroup name	P 31 2 1
Unit cell lengths	46.075, 46.075, 51.282
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	31.490 - 1.090
R-factor	0.1115
Rwork	0.111
R-free	0.12180
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.015
RMSD bond angle	1.595
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	31.492	1.109
High resolution limit [Å]	1.090	1.090
Rmerge	0.079
Number of reflections	26621	1252
<I/σ(I)>	18.9
Completeness [%]	99.6
Redundancy	17.6
CC(1/2)	0.999	0.909

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M imidazole, 1.0 M sodium acetate, pH 6.5