9VVV

Crystal structure of USP15 catalytic domain in complex with Ub-PA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL02U1
Synchrotron site	SSRF
Beamline	BL02U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-01-02
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.97919
Spacegroup name	C 2 2 21
Unit cell lengths	130.873, 131.851, 139.733
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.677 - 2.304
R-factor	0.2242
Rwork	0.222
R-free	0.27320
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.015
RMSD bond angle	1.443
Data reduction software	XDS
Data scaling software	Aimless (0.7.4)
Phasing software	PHASER
Refinement software	PHENIX ((1.14_3260: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	77.350	2.386
High resolution limit [Å]	2.304	2.304
Rmerge	0.072	0.955
Rmeas	0.079
Rpim	0.030	0.512
Number of reflections	53563	5204
<I/σ(I)>	9.6	9.6
Completeness [%]	99.9	100
Redundancy	5.7	4.7
CC(1/2)	0.995	0.538

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	50% MPD, 0.1M Imidazole