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2DEW

Crystal structure of human peptidylarginine deiminase 4 in complex with histone H3 N-terminal tail including Arg8

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL38B1
Synchrotron siteSPring-8
BeamlineBL38B1
Temperature [K]100
Detector technologyCCD
Collection date2004-04-14
DetectorADSC QUANTUM 4
Wavelength(s)1.000
Spacegroup nameC 1 2 1
Unit cell lengths146.268, 60.773, 115.146
Unit cell angles90.00, 124.26, 90.00
Refinement procedure
Resolution38.340 - 2.100
R-factor0.20575
Rwork0.202
R-free0.24078
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1wda
RMSD bond length0.012
RMSD bond angle1.465
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]38.3402.170
High resolution limit [Å]2.1002.100
Number of reflections48003
Completeness [%]97.997.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP82930.1M Imidazole (pH8.0), 0.2M lithium sulfate, 10% PEGMME2000, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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