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5TV7

2.05 Angstrom Resolution Crystal Structure of Peptidoglycan-Binding Protein from Clostridioides difficile in Complex with Glutamine Hydroxamate.

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 21-ID-F
Synchrotron siteAPS
Beamline21-ID-F
Temperature [K]100
Detector technologyCCD
Collection date2014-06-04
DetectorMARMOSAIC 300 mm CCD
Wavelength(s)0.97872
Spacegroup nameC 1 2 1
Unit cell lengths134.949, 35.008, 101.533
Unit cell angles90.00, 126.25, 90.00
Refinement procedure
Resolution29.080 - 2.050
R-factor0.17346
Rwork0.172
R-free0.21030
Structure solution methodSAD
RMSD bond length0.008
RMSD bond angle1.313
Data reduction softwareHKL-3000
Data scaling softwareHKL-3000
Phasing softwarePHENIX
Refinement softwareREFMAC (5.8.0155)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]29.0802.090
High resolution limit [Å]2.0502.050
Rmerge0.0930.769
Number of reflections24487
<I/σ(I)>28.12.06
Completeness [%]100.099.9
Redundancy55
CC(1/2)0.769
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP8.5295Protein: 7.8 mg/ml, 0.25M Sodium chloride, 0.01M Tris HCl (pH 8.3), Screen: JCSG+ (B3), 0.1M Bicine (pH 8.5), 20% (w/v) PEG 6000.

217705

数据于2024-03-27公开中

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