8GYN

zebrafish TIPE1 strucutre in complex with PE

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	CCD
Collection date	2020-05-31
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97918
Spacegroup name	P 1 21 1
Unit cell lengths	34.080, 65.920, 35.490
Unit cell angles	90.00, 106.55, 90.00

Refinement procedure

Resolution	25.660 - 1.380
R-factor	0.1488
Rwork	0.146
R-free	0.18400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3f4m
RMSD bond length	0.004
RMSD bond angle	0.617
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]	34.020	1.420
High resolution limit [Å]	1.380	1.380
Rmerge	0.057	0.394
Number of reflections	30289	2169
<I/σ(I)>	16.4	4.7
Completeness [%]	98.8	94.9
Redundancy	6.1	4.5
CC(1/2)	0.997	0.888

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	0.1 M succinic acid, pH 7.0, 12% (w/v) PEG 3350