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2Y5N

Structure of the mixed-function P450 MycG in complex with mycinamicin V in P21 space group

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 8.3.1
Synchrotron siteALS
Beamline8.3.1
Temperature [K]110
Detector technologyCCD
Collection date2009-07-15
DetectorADSC QUANTUM 315r
Spacegroup nameP 1 21 1
Unit cell lengths82.752, 57.428, 101.929
Unit cell angles90.00, 113.47, 90.00
Refinement procedure
Resolution75.910 - 1.620
R-factor0.1183
Rwork0.115
R-free0.18821
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2Y4H
RMSD bond length0.023
RMSD bond angle1.904
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareMOLREP
Refinement softwareREFMAC (5.5.0109)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]93.5001.700
High resolution limit [Å]1.6101.610
Rmerge0.0400.300
Number of reflections79430
<I/σ(I)>16.22.2
Completeness [%]70.411.1
Redundancy3.51.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
172967% PEG 4000, 0.025 M MG ACETATE, 23 DEGREES C, pH 7.0

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