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- PDB-3gzy: Crystal Structure of the Biphenyl Dioxygenase from Comamonas test... -
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Open data
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Basic information
Entry | Database: PDB / ID: 3gzy | ||||||
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Title | Crystal Structure of the Biphenyl Dioxygenase from Comamonas testosteroni Sp. Strain B-356 | ||||||
![]() | (Biphenyl dioxygenase subunit ...) x 2 | ||||||
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Function / homology | ![]() ![]() ![]() Similarity search - Function | ||||||
Biological species | ![]() ![]() | ||||||
Method | ![]() ![]() ![]() | ||||||
![]() | Kumar, P. / Colbert, C.L. / Bolin, J.T. | ||||||
![]() | ![]() Title: Structural Characterization of Pandoraea pnomenusa B-356 Biphenyl Dioxygenase Reveals Features of Potent Polychlorinated Biphenyl-Degrading Enzymes Authors: Colbert, C.L. / Agar, N.Y. / Kumar, P. / Chakko, M.N. / Sinha, S.C. / Powlowski, J.B. / Eltis, L.D. / Bolin, J.T. | ||||||
History |
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Structure visualization
Structure viewer | Molecule: ![]() ![]() |
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Downloads & links
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Download
PDBx/mmCIF format | ![]() | 155.7 KB | Display | ![]() |
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PDB format | ![]() | 119.8 KB | Display | ![]() |
PDBx/mmJSON format | ![]() | Tree view | ![]() | |
Others | ![]() |
-Validation report
Arichive directory | ![]() ![]() | HTTPS FTP |
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-Related structure data
Related structure data | ![]() 3gzxC ![]() 1ndoS ![]() 3gzz C: citing same article ( S: Starting model for refinement |
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Similar structure data |
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Links
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Assembly
Deposited unit | ![]()
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1 | ![]()
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Unit cell |
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Components on special symmetry positions |
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Components
-Biphenyl dioxygenase subunit ... , 2 types, 2 molecules AB
#1: Protein | Mass: 51751.527 Da / Num. of mol.: 1 Source method: isolated from a genetically manipulated source Source: (gene. exp.) ![]() ![]() ![]() ![]() ![]() ![]() |
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#2: Protein | Mass: 21583.422 Da / Num. of mol.: 1 Source method: isolated from a genetically manipulated source Source: (gene. exp.) ![]() ![]() ![]() ![]() ![]() ![]() |
-Non-polymers , 4 types, 583 molecules ![](data/chem/img/FE2.gif)
![](data/chem/img/FES.gif)
![](data/chem/img/MES.gif)
![](data/chem/img/HOH.gif)
![](data/chem/img/FES.gif)
![](data/chem/img/MES.gif)
![](data/chem/img/HOH.gif)
#3: Chemical | ChemComp-FE2 / |
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#4: Chemical | ChemComp-FES / ![]() |
#5: Chemical | ChemComp-MES / ![]() |
#6: Water | ChemComp-HOH / ![]() |
-Experimental details
-Experiment
Experiment | Method: ![]() |
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Sample preparation
Crystal | Density Matthews: 2.59 Å3/Da / Density % sol: 52.46 % |
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Crystal grow![]() | Temperature: 298 K / Method: vapor diffusion, sitting drop / pH: 6 Details: 20-15% PEG 4000, 100mM MES, 10-15% 2-PROPANOL, SODIUM CHLORIDE, PH 6.0, VAPOR DIFFUSION, SITTING DROP, temperature 298K |
-Data collection
Diffraction | Mean temperature: 100 K |
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Diffraction source | Source: ![]() ![]() ![]() |
Detector | Type: MARRESEARCH / Detector: CCD |
Radiation | Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray |
Radiation wavelength | Wavelength![]() |
Reflection | Resolution: 1.62→50 Å / Num. all: 91600 / Num. obs: 91600 / % possible obs: 99.4 % / Observed criterion σ(I): 2 / Redundancy: 2.9 % / Rmerge(I) obs: 0.067 / Rsym value: 0.067 / Net I/σ(I): 13 |
Reflection shell | Resolution: 1.62→1.69 Å / Redundancy: 2.9 % / Rmerge(I) obs: 0.194 / Mean I/σ(I) obs: 5.5 / Rsym value: 0.194 / % possible all: 99.4 |
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Processing
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Refinement | Method to determine structure![]() ![]() Starting model: PDB ENTRY 1NDO Resolution: 1.62→39.33 Å / Num. parameters: 22850 / Num. restraintsaints: 21403 / Cross valid method: FREE R / σ(F): 0 / Stereochemistry target values: ENGH AND HUBER
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Refine analyze | Num. disordered residues: 12 / Occupancy sum hydrogen: 0 / Occupancy sum non hydrogen: 5520.45 | |||||||||||||||||||||||||||||||||
Refinement step | Cycle: LAST / Resolution: 1.62→39.33 Å
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Refine LS restraints |
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