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Open data
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Basic information
Entry | Database: PDB / ID: 1zey | ||||||||||||||||||
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Title | CGG A-DNA | ||||||||||||||||||
![]() | 5'-D(*![]() DNA / Crystallographic Screen / DNA Structure / Holliday Junction / Molecular Structure | Function / homology | DNA | ![]() Method | ![]() ![]() ![]() Hays, F.A. / Teegarden, A.T. / Jones, Z.J.R. / Harms, M. / Raup, D. / Watson, J. / Cavaliere, E. / Ho, P.S. | ![]() ![]() Title: How sequence defines structure: a crystallographic map of DNA structure and conformation. Authors: Hays, F.A. / Teegarden, A. / Jones, Z.J. / Harms, M. / Raup, D. / Watson, J. / Cavaliere, E. / Ho, P.S. History |
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Structure visualization
Structure viewer | Molecule: ![]() ![]() |
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Downloads & links
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Download
PDBx/mmCIF format | ![]() | 22.2 KB | Display | ![]() |
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PDB format | ![]() | 14.5 KB | Display | ![]() |
PDBx/mmJSON format | ![]() | Tree view | ![]() | |
Others | ![]() |
-Validation report
Summary document | ![]() | 379.9 KB | Display | ![]() |
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Full document | ![]() | 384.1 KB | Display | |
Data in XML | ![]() | 4.4 KB | Display | |
Data in CIF | ![]() | 5.8 KB | Display | |
Arichive directory | ![]() ![]() | HTTPS FTP |
-Related structure data
Related structure data | ![]() 1zewC ![]() 1zexC ![]() 1zezC ![]() 1zf0C ![]() 1zf1C ![]() 1zf2C ![]() 1zf3C ![]() 1zf4C ![]() 1zf5C ![]() 1zf6C ![]() 1zf7C ![]() 1zf8C ![]() 1zf9C ![]() 1zfaC ![]() 1zfbC ![]() 1zfcC ![]() 1zfeC ![]() 1zffC ![]() 1zfgC ![]() 1zfhC ![]() 1zfmC C: citing same article ( |
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Similar structure data |
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Links
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Assembly
Deposited unit | ![]()
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Unit cell |
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Components
#1: DNA chain | Mass: 3046.980 Da / Num. of mol.: 2 / Source method: obtained synthetically Details: BIOSYSTEMS DNA SYNTHESIZER USING PHOSPHORAMIDITE CHEMISTRY, WITH THE TRITYL-PROTECTING GROUP LEFT INTACT AT THE 5'- TERMINAL NUCLEOTIDE THEN DEPROTECTED BY TREATMENT WITH 3% ACETIC ACID FOR ...Details: BIOSYSTEMS DNA SYNTHESIZER USING PHOSPHORAMIDITE CHEMISTRY, WITH THE TRITYL-PROTECTING GROUP LEFT INTACT AT THE 5'- TERMINAL NUCLEOTIDE THEN DEPROTECTED BY TREATMENT WITH 3% ACETIC ACID FOR FIFTEEN MINUTES, NEUTRALIZED WITH AMMONIUM HYDROXIDE, AND DESALTED ON A SIGMA G-25 SEPHADEX COLUMN. #2: Chemical | #3: Water | ChemComp-HOH / | |
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-Experimental details
-Experiment
Experiment | Method: ![]() |
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Sample preparation
Crystal | Density Matthews: 2.12 Å3/Da / Density % sol: 42.1 % | ||||||||||||||||||||||||||||||||||||||||
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Crystal grow | Temperature: 298 K / pH: 7 Details: Na Cacodylate, CaCl2, Spermine, MPD in resevoir, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 298K, pH 7.00 | ||||||||||||||||||||||||||||||||||||||||
Components of the solutions |
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-Data collection
Diffraction | Mean temperature: 103 K |
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Diffraction source | Source: ![]() |
Detector | Type: RIGAKU RAXIS IV / Detector: IMAGE PLATE / Date: Dec 19, 2004 |
Radiation | Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray |
Radiation wavelength | Wavelength: 1.542 Å / Relative weight: 1 |
Reflection | Resolution: 1.65→99 Å / Num. obs: 5690 / % possible obs: 84.8 % / Observed criterion σ(I): 2 / Biso Wilson estimate: 3.1 Å2 / Rmerge(I) obs: 0.078 |
Reflection shell | Resolution: 1.65→1.71 Å / Rmerge(I) obs: 0.077 / Mean I/σ(I) obs: 8.7 / Rsym value: 0.077 / % possible all: 57.8 |
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Processing
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Refinement | Method to determine structure: ![]() Starting model: ndb entries ADJ049 and AD0046 Resolution: 1.7→22.16 Å / Cor.coef. Fo:Fc: 0.749 / Cor.coef. Fo:Fc free: 0.612 / SU B: 4.657 / SU ML: 0.154 / Cross valid method: THROUGHOUT / σ(F): 2 / ESU R: 0.197 / ESU R Free: 0.186 / Stereochemistry target values: MAXIMUM LIKELIHOOD Details: STRUCTURE IS NOT REFINED TO ITS LOWEST R VALUES. PLEASE REFER TO CITED REFERENCE FOR MORE INFORMATION.
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Solvent computation | Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: MASK | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Displacement parameters | Biso mean: 3.86 Å2
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Refinement step | Cycle: LAST / Resolution: 1.7→22.16 Å
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Refine LS restraints |
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LS refinement shell | Resolution: 1.7→1.81 Å / Total num. of bins used: 6
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