4XVY

MycF mycinamicin III 3'-O-methyltransferase in complex with SAH

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	CCD
Collection date	2009-03-11
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	1.0332
Spacegroup name	P 21 21 21
Unit cell lengths	50.057, 89.892, 127.655
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.730 - 2.420
R-factor	0.20889
Rwork	0.206
R-free	0.25807
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4xvz
RMSD bond length	0.013
RMSD bond angle	1.539
Data reduction software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0073)

Data quality characteristics

	Overall
Low resolution limit [Å]	43.730
High resolution limit [Å]	2.400
Number of reflections	22837
<I/σ(I)>	15.1
Completeness [%]	98.4
Redundancy	6.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		293.1	20-30% PEG 3350, 100 mM BisTrisPropane pH 6.5