+Open data
-Basic information
Entry | Database: PDB / ID: 5lh7 | ||||||
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Title | High dose Thaumatin - 760-800 ms. | ||||||
Components | Thaumatin-1 | ||||||
Keywords | PLANT PROTEIN / Multicrystal / Room-Temperature / Thaumatin | ||||||
Function / homology | Function and homology information | ||||||
Biological species | Thaumatococcus daniellii (katemfe) | ||||||
Method | X-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.28 Å | ||||||
Authors | Schubert, R. / Kapis, S. / Heymann, M. / Giquel, Y. / Bourenkov, G. / Schneider, T. / Betzel, C. / Perbandt, M. | ||||||
Citation | Journal: IUCrJ / Year: 2016 Title: A multicrystal diffraction data-collection approach for studying structural dynamics with millisecond temporal resolution. Authors: Schubert, R. / Kapis, S. / Gicquel, Y. / Bourenkov, G. / Schneider, T.R. / Heymann, M. / Betzel, C. / Perbandt, M. | ||||||
History |
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-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Downloads & links
-Download
PDBx/mmCIF format | 5lh7.cif.gz | 54 KB | Display | PDBx/mmCIF format |
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PDB format | pdb5lh7.ent.gz | 38.3 KB | Display | PDB format |
PDBx/mmJSON format | 5lh7.json.gz | Tree view | PDBx/mmJSON format | |
Others | Other downloads |
-Validation report
Arichive directory | https://data.pdbj.org/pub/pdb/validation_reports/lh/5lh7 ftp://data.pdbj.org/pub/pdb/validation_reports/lh/5lh7 | HTTPS FTP |
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-Related structure data
Related structure data | 5lh0C 5lh1C 5lh3C 5lh5C 5lh6C 5lmhC 5ln0C 1lr2S S: Starting model for refinement C: citing same article (ref.) |
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Similar structure data |
-Links
-Assembly
Deposited unit |
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1 |
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Unit cell |
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-Components
#1: Protein | Mass: 22227.059 Da / Num. of mol.: 1 / Source method: isolated from a natural source / Source: (natural) Thaumatococcus daniellii (katemfe) / References: UniProt: P02883 | ||
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#2: Chemical | #3: Water | ChemComp-HOH / | |
-Experimental details
-Experiment
Experiment | Method: X-RAY DIFFRACTION / Number of used crystals: 1 |
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-Sample preparation
Crystal | Density Matthews: 2.91 Å3/Da / Density % sol: 57.78 % |
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Crystal grow | Temperature: 293 K / Method: vapor diffusion, hanging drop / pH: 6.5 / Details: 1.3 M sodium tartrate and 50 mM Tris, pH 6.8 |
-Data collection
Diffraction | Mean temperature: 296 K |
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Diffraction source | Source: SYNCHROTRON / Site: PETRA III, EMBL c/o DESY / Beamline: P14 (MX2) / Wavelength: 0.96863 Å |
Detector | Type: DECTRIS PILATUS 6M / Detector: PIXEL / Date: Oct 24, 2015 |
Radiation | Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray |
Radiation wavelength | Wavelength: 0.96863 Å / Relative weight: 1 |
Reflection | Resolution: 2.28→30 Å / Num. obs: 11604 / % possible obs: 90.1 % / Redundancy: 3 % / Biso Wilson estimate: 39.589 Å2 / Rmerge(I) obs: 0.196 / Net I/σ(I): 5.9 |
Reflection shell | Resolution: 2.28→2.36 Å / Rmerge(I) obs: 0.835 |
-Processing
Software |
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Refinement | Method to determine structure: MOLECULAR REPLACEMENT Starting model: 1LR2 Resolution: 2.28→19.94 Å / Cor.coef. Fo:Fc: 0.961 / Cor.coef. Fo:Fc free: 0.934 / SU B: 6.361 / SU ML: 0.148 / Cross valid method: THROUGHOUT / ESU R: 0.227 / ESU R Free: 0.203 / Details: U VALUES : REFINED INDIVIDUALLY
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Solvent computation | Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Displacement parameters | Biso max: 209.17 Å2 / Biso mean: 31.766 Å2 / Biso min: 14.23 Å2
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Refinement step | Cycle: final / Resolution: 2.28→19.94 Å
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Refine LS restraints |
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LS refinement shell | Resolution: 2.26→2.318 Å / Total num. of bins used: 20
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