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4FD4

Crystal structure of mosquito arylalkylamine N-Acetyltransferase like 5b

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X29A
Synchrotron siteNSLS
BeamlineX29A
Detector technologyCCD
Collection date2011-03-18
DetectorADSC QUANTUM 315r
Wavelength(s)1.0750
Spacegroup nameP 21 21 21
Unit cell lengths38.168, 72.753, 149.849
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution41.180 - 1.950
R-factor0.21043
Rwork0.208
R-free0.25179
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)aaNAT2 from Aedes aegypti
RMSD bond length0.009
RMSD bond angle1.130
Data reduction softwareHKL-2000
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwareREFMAC (5.5.0109)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]41.1802.020
High resolution limit [Å]1.9501.950
Rmerge0.1000.710
<I/σ(I)>214
Redundancy11.810.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.629325.5% polyethylene glycol 4000, and 17% glycerol, 0.1 m sodium citrate, pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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