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2GVY

Monoclinic crystal form of Aspergillus niger alpha-amylase in complex with maltose at 1.8 A resolution

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID29
Synchrotron siteESRF
BeamlineID29
Temperature [K]100
Detector technologyCCD
Collection date2005-12-15
DetectorADSC QUANTUM 210
Wavelength(s)0.97910
Spacegroup nameP 1 21 1
Unit cell lengths65.451, 101.149, 75.185
Unit cell angles90.00, 103.89, 90.00
Refinement procedure
Resolution20.000 - 1.800
R-factor0.165
Rwork0.162
R-free0.21000
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.018
RMSD bond angle1.674
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]72.9871.900
High resolution limit [Å]1.8001.800
Rmerge0.1040.578
Total number of observations82342
Number of reflections84823
<I/σ(I)>5.81.3
Completeness [%]96.695
Redundancy76.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.529630% PEG 6000, 0.1M ammonium sulphate, 0.1M MES, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 296K

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