8WHH

Crystal structure of Se-Met derivative CLASP2 in complex with CLIP170

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-07-14
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.987
Spacegroup name	P 21 21 21
Unit cell lengths	86.115, 100.826, 226.065
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.427 - 3.801
R-factor	0.2193
Rwork	0.217
R-free	0.26630
Structure solution method	SAD
RMSD bond length	0.004
RMSD bond angle	0.821
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	AutoSol
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	3.870
High resolution limit [Å]	3.800	10.290	3.800
Rmerge	0.128	0.054	1.212
Rmeas	0.137	0.058	1.295
Rpim	0.049	0.022	0.453
Total number of observations	291365
Number of reflections	37419	1889	1873
<I/σ(I)>	3.1
Completeness [%]	100.0	99.7	100
Redundancy	7.8	7.6	8
CC(1/2)	0.994	0.997	0.838

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		289	0.2 M ammonium acetate, 0.1 M Tris pH 8.5, 25% w/v PEG 3,350