6ASK

Crystal Structure of apo Flavin monooxygenase CmoJ (earlier YtnJ)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-D
Synchrotron site	APS
Beamline	23-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-02-25
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.033
Spacegroup name	P 43 21 2
Unit cell lengths	86.751, 86.751, 195.420
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	64.870 - 1.690
R-factor	0.175
Rwork	0.174
R-free	0.19000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1yw1
RMSD bond length	0.006
RMSD bond angle	0.750
Data scaling software	iMOSFLM (7.2.1)
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	64.870	1.740
High resolution limit [Å]	1.690	1.690
Rmerge	0.140	1.884
Number of reflections	84371
<I/σ(I)>	12.1	1.4
Completeness [%]	100.0	100
Redundancy	21.2	23.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	277	50 mM HEPES pH7.5, 200 mM KCl, 29%-33% pentaerythritol propoxylate (5/4 PO/OH)