8SZX

Crystal structure of b'-WD40 Lys17Ala mutant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-1
Synchrotron site	NSLS-II
Beamline	17-ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-05-22
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.92
Spacegroup name	I 41
Unit cell lengths	158.189, 158.189, 47.567
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	27.960 - 2.000
R-factor	0.1921
Rwork	0.190
R-free	0.23350
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.644
Data reduction software	HKL-3000
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487+SVN)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	27.960	2.050
High resolution limit [Å]	2.000	2.000
Number of reflections	40138	2931
<I/σ(I)>	3.9	1.8
Completeness [%]	99.9	100
Redundancy	4.7	4.7
CC(1/2)	0.955	0.683

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		295.15	0.1M MES pH 6.5, PEG 19% 20000