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2YMK

Crystal structure of the hexameric anti-microbial peptide channel dermcidin

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X10SA
Synchrotron siteSLS
BeamlineX10SA
Temperature [K]100
Detector technologyPIXEL
DetectorDECTRIS PILATUS 6M
Spacegroup nameC 1 2 1
Unit cell lengths76.354, 50.724, 45.738
Unit cell angles90.00, 117.74, 90.00
Refinement procedure
Resolution33.790 - 2.490
R-factor0.20838
Rwork0.205
R-free0.27384
Structure solution methodSAD
Starting model (for MR)NONE
RMSD bond length0.023
RMSD bond angle2.333
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareSHARP
Refinement softwareREFMAC (5.5.0102)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]33.0002.560
High resolution limit [Å]2.5002.500
Rmerge0.0200.510
Number of reflections5189
<I/σ(I)>172.95
Completeness [%]98.896.8
Redundancy7.27.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
16.50.2 M ZN(AC)2, 0.1 M NA-CACODYLATE, 18% PEG8000 AT PH 6.5

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PDB entries from 2024-05-15

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