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4OLT

Chitosanase complex structure

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL17U
Synchrotron siteSSRF
BeamlineBL17U
Temperature [K]77
Detector technologyCCD
DetectorADSC QUANTUM 315r
Spacegroup nameP 1 21 1
Unit cell lengths62.023, 40.705, 104.794
Unit cell angles90.00, 106.53, 90.00
Refinement procedure
Resolution33.900 - 1.590
R-factor0.164
Rwork0.161
R-free0.22600
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1chk
RMSD bond length0.020
RMSD bond angle1.814
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwareREFMAC (5.7.0032)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]33.9001.640
High resolution limit [Å]1.5901.590
Rmerge0.250
Number of reflections63744
<I/σ(I)>12.71.6
Completeness [%]99.499.7
Redundancy6.55.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
12880.05 M KH2PO4, 23% PEG 8000, VAPOR DIFFUSION, HANGING DROP, temperature 288K

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