7CFU

Crystal Structure of FMN-dependent Cysteine Decarboxylases SpaF

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-11-03
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9793
Spacegroup name	P 1 21 1
Unit cell lengths	94.629, 189.609, 185.349
Unit cell angles	90.00, 92.52, 90.00

Refinement procedure

Resolution	48.960 - 2.150
R-factor	0.2046
Rwork	0.203
R-free	0.23540
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6jls
RMSD bond length	0.005
RMSD bond angle	0.706
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.14_3235)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.960	2.190
High resolution limit [Å]	2.150	2.150
Number of reflections	345160	17051
<I/σ(I)>	6.8
Completeness [%]	97.8
Redundancy	3.4
CC(1/2)	0.995	0.589

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		295	2.0M NaCl, 0.1M potassium phosphate mono basic, 0.1M sodium phosphate monobasic, 0.1M MES pH 6.5