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1GOI

Crystal structure of the D140N mutant of chitinase B from Serratia marcescens at 1.45 A resolution

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID14-4
Synchrotron siteESRF
BeamlineID14-4
Temperature [K]100
Detector technologyCCD
Collection date2000-11-15
DetectorADSC QUANTUM 4
Spacegroup nameP 21 21 21
Unit cell lengths55.904, 104.016, 186.524
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution17.000 - 1.450
R-factor0.164

*

R-free0.22700

*

Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1e15
RMSD bond length0.017

*

RMSD bond angle2.320

*

Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Refinement softwareSHELXL-97
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]17.0001.500
High resolution limit [Å]1.4501.450
Rmerge0.0370.380
Total number of observations600078

*

Number of reflections191634
<I/σ(I)>14.72.7
Completeness [%]99.399.5
Redundancy3.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion, hanging drop

*

7100 MM HEPES, 1.25 M AMMONIUM SULPHATE, 10% GLYCEROL, pH 7.00
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein10 (mg/ml)
21reservoirglycerol10 (%)
31reservoirammonium sulfate1.25 (M)
41reservoirHEPES100 (mM)pH7.

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PDB entries from 2024-05-15

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