7EHK

Crystal structure of C107S mutant of FfIBP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-03-25
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.987
Spacegroup name	P 41 2 2
Unit cell lengths	69.620, 69.620, 178.740
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.400 - 2.000
R-factor	0.229
Rwork	0.228
R-free	0.24810
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4nu2
RMSD bond length	0.007
RMSD bond angle	1.000
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	PHENIX (1.18.2)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.400	2.050
High resolution limit [Å]	2.000	2.000
Number of reflections	30586	2213
<I/σ(I)>	23.7
Completeness [%]	99.9
Redundancy	26.2
CC(1/2)	0.990	0.960

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1M sodium acetate pH 4.6, 3M sodium chloride