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Yorodumi- PDB-2w7r: Structure of the PDZ domain of Human Microtubule associated serin... -
+Open data
-Basic information
Entry | Database: PDB / ID: 2w7r | ||||||
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Title | Structure of the PDZ domain of Human Microtubule associated serine- threonine kinase 4 | ||||||
Components | MICROTUBULE-ASSOCIATED SERINE/THREONINE-PROTEIN KINASE 4 | ||||||
Keywords | TRANSFERASE | ||||||
Function / homology | Function and homology information cytoskeleton organization / peptidyl-serine phosphorylation / non-specific serine/threonine protein kinase / intracellular signal transduction / protein serine/threonine kinase activity / magnesium ion binding / ATP binding / cytoplasm Similarity search - Function | ||||||
Biological species | HOMO SAPIENS (human) | ||||||
Method | X-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 1.6 Å | ||||||
Authors | Muniz, J.R.C. / Elkins, J. / Wang, J. / Savitzky, P. / Roos, A. / Salah, E. / von Delft, F. / Arrowsmith, C.H. / Edwards, A.M. / Weigelt, J. ...Muniz, J.R.C. / Elkins, J. / Wang, J. / Savitzky, P. / Roos, A. / Salah, E. / von Delft, F. / Arrowsmith, C.H. / Edwards, A.M. / Weigelt, J. / Bountra, C. / Knapp, S. | ||||||
Citation | Journal: Protein Sci. / Year: 2010 Title: Unusual Binding Interactions in Pdz Domain Crystal Structures Help Explain Binding Mechanisms. Authors: Elkins, J.M. / Gileadi, C. / Shrestha, L. / Phillips, C. / Wang, J. / Muniz, J.R.C. / Doyle, D.A. | ||||||
History |
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Remark 700 | SHEET THE SHEET STRUCTURE OF THIS MOLECULE IS BIFURCATED. IN ORDER TO REPRESENT THIS FEATURE IN ... SHEET THE SHEET STRUCTURE OF THIS MOLECULE IS BIFURCATED. IN ORDER TO REPRESENT THIS FEATURE IN THE SHEET RECORDS BELOW, TWO SHEETS ARE DEFINED. |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Downloads & links
-Download
PDBx/mmCIF format | 2w7r.cif.gz | 87.2 KB | Display | PDBx/mmCIF format |
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PDB format | pdb2w7r.ent.gz | 67.6 KB | Display | PDB format |
PDBx/mmJSON format | 2w7r.json.gz | Tree view | PDBx/mmJSON format | |
Others | Other downloads |
-Validation report
Summary document | 2w7r_validation.pdf.gz | 430.3 KB | Display | wwPDB validaton report |
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Full document | 2w7r_full_validation.pdf.gz | 430.8 KB | Display | |
Data in XML | 2w7r_validation.xml.gz | 10.6 KB | Display | |
Data in CIF | 2w7r_validation.cif.gz | 14.5 KB | Display | |
Arichive directory | https://data.pdbj.org/pub/pdb/validation_reports/w7/2w7r ftp://data.pdbj.org/pub/pdb/validation_reports/w7/2w7r | HTTPS FTP |
-Related structure data
Related structure data | 2pa1C 2pktC 2pntC 2q3gC 2uzcC 2v1wC 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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Noncrystallographic symmetry (NCS) | NCS oper: (Code: given Matrix: (-0.5157, -0.8555, -0.048), Vector: |
-Components
#1: Protein | Mass: 10652.010 Da / Num. of mol.: 2 / Fragment: PDZ DOMAIN, RESIDUES 1143-1234 Source method: isolated from a genetically manipulated source Source: (gene. exp.) HOMO SAPIENS (human) / Production host: ESCHERICHIA COLI (E. coli) / Strain (production host): BL21(DE3) / Variant (production host): R3-PRARE2 References: UniProt: O15021, non-specific serine/threonine protein kinase #2: Chemical | ChemComp-PO4 / | #3: Water | ChemComp-HOH / | |
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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: 2.06 Å3/Da / Density % sol: 40.38 % / Description: NONE |
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Crystal grow | Details: 75MM NA PHOSPHATE, 91MM K PHOSPHATE |
-Data collection
Diffraction | Mean temperature: 287 K |
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Diffraction source | Source: SYNCHROTRON / Site: SLS / Beamline: X10SA / Wavelength: 1 |
Detector | Type: MARRESEARCH / Detector: CCD / Date: Jun 21, 2008 |
Radiation | Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray |
Radiation wavelength | Wavelength: 1 Å / Relative weight: 1 |
Reflection | Resolution: 1.64→29.14 Å / Num. obs: 32248 / % possible obs: 99.7 % / Observed criterion σ(I): 1.8 / Redundancy: 2.7 % / Biso Wilson estimate: 22.04 Å2 / Rmerge(I) obs: 0.05 / Net I/σ(I): 7.8 |
Reflection shell | Resolution: 1.64→1.73 Å / Redundancy: 2.7 % / Mean I/σ(I) obs: 1.8 / % possible all: 100 |
-Processing
Software |
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Refinement | Method to determine structure: MOLECULAR REPLACEMENT / Resolution: 1.6→27.19 Å / SU ML: 0.24 / σ(F): 0.02 / Phase error: 22.45 / Stereochemistry target values: ML
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Solvent computation | Shrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å / Solvent model: FLAT BULK SOLVENT MODEL / Bsol: 48.11 Å2 / ksol: 0.37 e/Å3 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Displacement parameters |
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Refinement step | Cycle: LAST / Resolution: 1.6→27.19 Å
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Refine LS restraints |
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LS refinement shell |
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Refinement TLS params. | Method: refined / Refine-ID: X-RAY DIFFRACTION
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Refinement TLS group |
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