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Yorodumi- PDB-3m9o: Crystal Structure of Dpo4 in complex with DNA containing the majo... -
+Open data
-Basic information
Entry | Database: PDB / ID: 3m9o | ||||||
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Title | Crystal Structure of Dpo4 in complex with DNA containing the major cisplatin lesion | ||||||
Components |
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Keywords | Transferase/DNA / Dpo4 / translesion DNA synthesis / TLS / cisplatin / Y-family DNA polymerase / protein-DNA complex / DNA / DNA damage / DNA repair / DNA replication / DNA-binding / DNA-directed DNA polymerase / Magnesium / Metal-binding / Mutator protein / Nucleotidyltransferase / Transferase / Transferase-DNA complex | ||||||
Function / homology | Function and homology information SOS response / error-prone translesion synthesis / DNA-templated DNA replication / damaged DNA binding / DNA-directed DNA polymerase / DNA-directed DNA polymerase activity / magnesium ion binding / cytosol Similarity search - Function | ||||||
Biological species | Sulfolobus solfataricus (archaea) | ||||||
Method | X-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2 Å | ||||||
Authors | Wong, J.H.Y. / Ling, H. | ||||||
Citation | Journal: Embo J. / Year: 2010 Title: Structural insight into dynamic bypass of the major cisplatin-DNA adduct by Y-family polymerase Dpo4. Authors: Wong, J.H. / Brown, J.A. / Suo, Z. / Blum, P. / Nohmi, T. / Ling, H. | ||||||
History |
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-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Downloads & links
-Download
PDBx/mmCIF format | 3m9o.cif.gz | 109.6 KB | Display | PDBx/mmCIF format |
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PDB format | pdb3m9o.ent.gz | 78.9 KB | Display | PDB format |
PDBx/mmJSON format | 3m9o.json.gz | Tree view | PDBx/mmJSON format | |
Others | Other downloads |
-Validation report
Arichive directory | https://data.pdbj.org/pub/pdb/validation_reports/m9/3m9o ftp://data.pdbj.org/pub/pdb/validation_reports/m9/3m9o | HTTPS FTP |
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-Related structure data
Related structure data | 3m9mC 3m9nC 1jx4S C: citing same article (ref.) 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
-Protein , 1 types, 1 molecules B
#1: Protein | Mass: 40257.879 Da / Num. of mol.: 1 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Sulfolobus solfataricus (archaea) / Strain: P2 / Gene: dbh, dpo4, SSO2448 / Plasmid: pET22b / Production host: Escherichia coli (E. coli) / Strain (production host): BL21(DE3) / References: UniProt: Q97W02, DNA-directed DNA polymerase |
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-DNA chain , 2 types, 2 molecules PT
#2: DNA chain | Mass: 4074.674 Da / Num. of mol.: 1 / Source method: obtained synthetically / Details: synthetic DNA oligo |
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#3: DNA chain | Mass: 5345.439 Da / Num. of mol.: 1 / Source method: obtained synthetically / Details: deoxynucleotides |
-Non-polymers , 4 types, 264 molecules
#4: Chemical | ChemComp-CA / #5: Chemical | ChemComp-ATP / | #6: Chemical | ChemComp-CPT / | #7: 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: 2.69 Å3/Da / Density % sol: 54.26 % |
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Crystal grow | Temperature: 298 K / Method: hanging drop / pH: 7.5 Details: 0.2M calcium acetate, 5% glycerol, 15% PEG 3350, 200mM NaCl, pH 7.5, hanging drop, temperature 298K |
-Data collection
Diffraction | Mean temperature: 100 K | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
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Diffraction source | Source: SYNCHROTRON / Site: APS / Beamline: 24-ID-C / Wavelength: 0.97949 Å | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Detector | Type: ADSC Q315 / Detector: CCD / Date: Nov 28, 2007 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Radiation | Monochromator: Cryo-Cooled Si(111) double crystal / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Radiation wavelength | Wavelength: 0.97949 Å / Relative weight: 1 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Reflection | Resolution: 2→50 Å / Num. all: 36847 / Num. obs: 36736 / % possible obs: 99.7 % / Observed criterion σ(F): 1 / Observed criterion σ(I): 1 / Redundancy: 8 % / Rmerge(I) obs: 0.087 / Χ2: 1.139 / Net I/σ(I): 9.1 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Reflection shell |
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-Processing
Software |
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Refinement | Method to determine structure: MOLECULAR REPLACEMENT Starting model: PDB ENTRY 1JX4 Resolution: 2→29 Å / Occupancy max: 1 / Occupancy min: 1 / FOM work R set: 0.845 / Cross valid method: THROUGHOUT / σ(F): 0 / Stereochemistry target values: Engh & Huber
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Solvent computation | Bsol: 34.862 Å2 | ||||||||||||||||||||||||||||
Displacement parameters | Biso max: 84.46 Å2 / Biso mean: 35.37 Å2 / Biso min: 16.54 Å2
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Refinement step | Cycle: LAST / Resolution: 2→29 Å
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Refine LS restraints |
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Xplor file |
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