7XRH

Feruloyl esterase from Lactobacillus acidophilus

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	2020-12-09
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.9794
Spacegroup name	P 21 21 21
Unit cell lengths	49.188, 74.590, 123.367
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.060 - 2.300
R-factor	0.2318
Rwork	0.227
R-free	0.28030
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3pf8
RMSD bond length	0.012
RMSD bond angle	1.324
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (1.14_3260)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.340
High resolution limit [Å]	2.300	2.300
Number of reflections	20175	1031
<I/σ(I)>	25.05	4.62
Completeness [%]	97.2
Redundancy	6.8
CC(1/2)	0.954	0.928

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	293	20 % (w/v) PEG MME 5000, 0.1 M Bis-Tris-HCl (pH 6.5)