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1UCS

Type III Antifreeze Protein RD1 from an Antarctic Eel Pout

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 19-ID
Synchrotron siteAPS
Beamline19-ID
Temperature [K]110
Detector technologyCCD
Collection date2000-01-23
DetectorCUSTOM-MADE
Wavelength(s)0.6668
Spacegroup nameP 21 21 21
Unit cell lengths32.501, 39.502, 44.640
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution50.000

*

- 0.620
R-factor0.137
Rwork0.133
R-free0.15500
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)A polypeptide model derived from NMR experiments
RMSD bond length0.012
RMSD bond angle2.100

*

Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareX-PLOR
Refinement softwareSHELXL-97
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]1.200

*

0.640
High resolution limit [Å]0.6200.620
Rmerge0.073

*

0.653
Total number of observations256420

*

Number of reflections108526

*

10198

*

<I/σ(I)>21.51.2
Completeness [%]97.0

*

91.8
Redundancy3.31.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.5298Ammonium Sulfate, Tris-HCl, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein40 (mg/ml)
21dropTris4 (mM)pH7.5
31dropammonium sulfate20 (%)
41reservoirammonium sulfate50 (%)

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