9NK1

Prenylated-FMN maturase PhdC from Mycolicibacterium fortuitum bound to flavin mononucleotide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-1
Synchrotron site	SSRL
Beamline	BL12-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-02-26
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.987
Spacegroup name	I 2 2 2
Unit cell lengths	60.039, 75.032, 79.746
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.965 - 1.230
Rwork	0.131
R-free	0.14810
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.017
RMSD bond angle	2.140
Data reduction software	autoPROC
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0430 (refmacat 0.4.88))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.970	1.250
High resolution limit [Å]	1.230	1.230
Rmerge	0.035	0.559
Rmeas	0.038	0.733
Rpim	0.015	0.466
Number of reflections	44741	1834
<I/σ(I)>	18.3	1.3
Completeness [%]	84.2	32.2
Redundancy	5.6	2.3
CC(1/2)	0.999	0.508

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	1:2 protein (20mM bistris pH 7.2, 200mM KCl, 1mM MnCl2, 5% glycerol +FMN reconstitution) to condition (30% w/v PEG 5000 MME, 100 mM MES/ Sodium hydroxide pH 6.5, 200 mM ammonium sulfate)