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1UFL

Crystal Structure of TT1020 from Thermus thermophilus HB8

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL44B2
Synchrotron siteSPring-8
BeamlineBL44B2
Temperature [K]100
Detector technologyCCD
Collection date2002-02-25
DetectorMARRESEARCH
Wavelength(s)0.9
Spacegroup nameP 31 2 1
Unit cell lengths97.070, 97.070, 56.560
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution48.540 - 2.700
Rwork0.230
R-free0.30700
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.008
RMSD bond angle24.400

*

Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.800
High resolution limit [Å]2.7002.700
Rmerge0.0600.321
Total number of observations91310

*

Number of reflections8743
<I/σ(I)>15.67.7
Completeness [%]99.292.4
Redundancy9.79.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8

*

16

*

iso-propanol, PEG4000, Na-Hepes, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 289K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein15 (mg/ml)
21dropTris-HCl0.02 (M)
31drop0.15 (M)pH8.
41reservoiriso-propanol7 (%)
51reservoirPEG400015 (%)
61reservoirsodium-Hepes0.05 (M)pH7.5

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