+Open data
-Basic information
Entry | Database: PDB / ID: 6tk9 | ||||||
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Title | Purine-nucleoside phosphorylase from Thermus thermophilus | ||||||
Components | Purine nucleoside phosphorylase | ||||||
Keywords | TRANSFERASE / phosphorylase | ||||||
Function / homology | Function and homology information nucleoside metabolic process / purine-nucleoside phosphorylase / purine-nucleoside phosphorylase activity Similarity search - Function | ||||||
Biological species | Thermus thermophilus (bacteria) | ||||||
Method | X-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.5 Å | ||||||
Authors | Timofeev, V.I. / Abramchik, Y.A. / Kostromina, M.A. / Tuzova, E.S. / Esipov, R.S. / Kuranova, I.P. | ||||||
Citation | Journal: To Be Published Title: Purine-nucleoside phosphorylase from Thermus thermophilus Authors: Timofeev, V.I. / Abramchik, Y.A. / Kostromina, M.A. / Tuzova, E.S. / Esipov, R.S. / Kuranova, I.P. | ||||||
History |
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-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Downloads & links
-Download
PDBx/mmCIF format | 6tk9.cif.gz | 313.1 KB | Display | PDBx/mmCIF format |
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PDB format | pdb6tk9.ent.gz | 256.1 KB | Display | PDB format |
PDBx/mmJSON format | 6tk9.json.gz | Tree view | PDBx/mmJSON format | |
Others | Other downloads |
-Validation report
Arichive directory | https://data.pdbj.org/pub/pdb/validation_reports/tk/6tk9 ftp://data.pdbj.org/pub/pdb/validation_reports/tk/6tk9 | HTTPS FTP |
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-Related structure data
Related structure data | 4uc0S S: Starting model for refinement |
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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: 29932.400 Da / Num. of mol.: 6 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Thermus thermophilus (bacteria) / Gene: TthHC11_05990 / Production host: Thermus thermophilus (bacteria) References: UniProt: A0A510IGW9, purine-nucleoside phosphorylase #2: Chemical | ChemComp-PO4 / #3: Water | ChemComp-HOH / | Has ligand of interest | N | |
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-Experimental details
-Experiment
Experiment | Method: X-RAY DIFFRACTION / Number of used crystals: 1 |
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-Sample preparation
Crystal | Density Matthews: 3.26 Å3/Da / Density % sol: 62.26 % |
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Crystal grow | Temperature: 297 K / Method: counter-diffusion / Details: SA |
-Data collection
Diffraction | Mean temperature: 100 K / Serial crystal experiment: N |
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Diffraction source | Source: SYNCHROTRON / Site: ESRF / Beamline: ID23-1 / Wavelength: 0.979 / Wavelength: 0.979 Å |
Detector | Type: DECTRIS EIGER R 1M / Detector: PIXEL / Date: Oct 12, 2019 |
Radiation | Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray |
Radiation wavelength | Wavelength: 0.979 Å / Relative weight: 1 |
Reflection | Resolution: 2.5→20 Å / Num. obs: 80416 / % possible obs: 98.1 % / Redundancy: 4.35 % / CC1/2: 0.998 / Rmerge(I) obs: 0.085 / Net I/σ(I): 13.32 |
Reflection shell | Resolution: 2.5→3 Å / Rmerge(I) obs: 0.435 / Num. unique obs: 33938 / CC1/2: 0.922 / Rrim(I) all: 0.491 |
-Processing
Software |
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Refinement | Method to determine structure: MOLECULAR REPLACEMENT Starting model: 4UC0 Resolution: 2.5→19.98 Å / Cor.coef. Fo:Fc: 0.94 / Cor.coef. Fo:Fc free: 0.911 / SU B: 10.587 / SU ML: 0.225 / Cross valid method: THROUGHOUT / σ(F): 0 / ESU R: 0.395 / ESU R Free: 0.278 Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS 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: 147.19 Å2 / Biso mean: 47.895 Å2 / Biso min: 21.22 Å2
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Refinement step | Cycle: final / Resolution: 2.5→19.98 Å
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Refine LS restraints |
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LS refinement shell | Resolution: 2.5→2.564 Å / Rfactor Rfree error: 0 / Total num. of bins used: 20
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