7A1I

Crystal structure of the BILBO2/FPC4 complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	77
Detector technology	PIXEL
Collection date	2017-09-30
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.97625
Spacegroup name	C 2 2 21
Unit cell lengths	60.418, 73.385, 120.514
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.750 - 1.870
R-factor	0.2156
Rwork	0.212
R-free	0.25070
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6SJQ.pdb
RMSD bond length	0.007
RMSD bond angle	0.810
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX (1.18_3845)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.640	1.937
High resolution limit [Å]	1.870	1.870
Rmerge	0.125	2.359
Rmeas	0.130	2.477
Rpim	0.037	0.727
Number of reflections	21911	1295
<I/σ(I)>	12.76	0.77
Completeness [%]	95.3	57.71
Redundancy	12.4	9.7
CC(1/2)	0.999	0.742

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.5	295	0.1 mM NaOAc (pH 4.5), 0.5 M 1,6-Hexanediol, and 10 mM CoCl2