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2PG8

Crystal structure of R254K mutanat of DpgC with bound substrate analog

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X12C
Synchrotron siteNSLS
BeamlineX12C
Temperature [K]100
Detector technologyCCD
Collection date2007-03-15
DetectorADSC QUANTUM 210
Wavelength(s)1.0
Spacegroup nameP 21 21 2
Unit cell lengths139.054, 155.309, 169.208
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution50.000 - 3.000
Rwork0.331
R-free0.36700
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2np9
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0003.110
High resolution limit [Å]3.0003.000
Rmerge0.1580.749
Number of reflections73630
<I/σ(I)>7.4
Completeness [%]99.699.3
Redundancy9.88.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.629315% PEG 4000, 0.1M sodium citrate, 0.15M ammonium acetate, pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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