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4F13

Alginate lyase A1-III Y246F complexed with tetrasaccharide

Replaces:  4E25Replaces:  3EW4
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL38B1
Synchrotron siteSPring-8
BeamlineBL38B1
Temperature [K]293
Detector technologyCCD
Collection date2004-04-11
DetectorADSC QUANTUM 4
Wavelength(s)1.00
Spacegroup nameP 21 21 21
Unit cell lengths65.571, 77.560, 145.678
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution48.733 - 2.208
R-factor0.179
Rwork0.177
R-free0.21440
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)PDB 4E1Y
RMSD bond length0.010
RMSD bond angle1.305
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]48.7332.240
High resolution limit [Å]2.2002.200
Rmerge0.0980.484
Number of reflections36529
<I/σ(I)>16.73
Completeness [%]96.295.9
Redundancy5.393.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.529324%(W/V) PEG4000, 0.3M AMMONIUM ACETATE, 0.1M SODIUM CITRATE, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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