9UCG

A Fab structure with a covalent bond

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-5A
Synchrotron site	Photon Factory
Beamline	BL-5A
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-07-01
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	1.0000
Spacegroup name	P 43 21 2
Unit cell lengths	101.233, 101.233, 212.417
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.240 - 2.650
R-factor	0.2238
Rwork	0.220
R-free	0.28130
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	1.110
Data reduction software	XDS
Data scaling software	XDS
Phasing software	MOLREP
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.240	2.780
High resolution limit [Å]	2.650	2.650
Rmerge	0.165	1.195
Number of reflections	32992	4265
<I/σ(I)>	15.2
Completeness [%]	100.0
Redundancy	13

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	293	0.1M Sodium Cacodylate pH6.5, 0.2M Magnesium Chloride, 41% PEG 300, Protein 16.0mg/mL