8XI9

Crystal structure of FRB-FKBP fusion protein in complex with rapamycin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-08-27
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0
Spacegroup name	P 63 2 2
Unit cell lengths	80.517, 80.517, 122.419
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	61.210 - 1.850
R-factor	0.1887
Rwork	0.187
R-free	0.21840
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.949
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	69.730	1.890
High resolution limit [Å]	1.850	1.850
Rmerge	0.059	0.335
Rmeas	0.060	0.343
Rpim	0.013	0.075
Number of reflections	20689	1239
<I/σ(I)>	44.9	13.2
Completeness [%]	99.9
Redundancy	37.3
CC(1/2)	1.000	0.992

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.4	293	4.4M Sodium Acetate