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Open data
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Basic information
Entry | Database: PDB / ID: 1nni | ||||||
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Title | Azobenzene Reductase from Bacillus subtilis | ||||||
![]() | hypothetical protein yhda | ||||||
![]() | OXIDOREDUCTASE / azobenzene reductase / azoreductase / structural genomics / flavoproteins / PSI / Protein Structure Initiative / Midwest Center for Structural Genomics / MCSG | ||||||
Function / homology | ![]() Oxidoreductases; Acting on other nitrogenous compounds as donors / FMN binding / oxidoreductase activity / identical protein binding / cytosol Similarity search - Function | ||||||
Biological species | ![]() ![]() | ||||||
Method | ![]() ![]() ![]() | ||||||
![]() | Cuff, M.E. / Kim, Y. / Maj, L. / Collart, F. / Joachimiak, A. / Midwest Center for Structural Genomics (MCSG) | ||||||
![]() | ![]() Title: Azobenzene Reductase from Bacillus subtilis Authors: Cuff, M.E. / Kim, Y. / Maj, L. / Collart, F. / Joachimiak, A. | ||||||
History |
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Structure visualization
Structure viewer | Molecule: ![]() ![]() |
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Downloads & links
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Download
PDBx/mmCIF format | ![]() | 46.6 KB | Display | ![]() |
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PDB format | ![]() | 36.6 KB | Display | ![]() |
PDBx/mmJSON format | ![]() | Tree view | ![]() | |
Others | ![]() |
-Validation report
Summary document | ![]() | 775.7 KB | Display | ![]() |
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Full document | ![]() | 783.7 KB | Display | |
Data in XML | ![]() | 11.8 KB | Display | |
Data in CIF | ![]() | 15.9 KB | Display | |
Arichive directory | ![]() ![]() | HTTPS FTP |
-Related structure data
Similar structure data | |
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Other databases |
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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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Details | likely a dimer related by the crystallographic two fold axis: 1-y, 1-x, 3/2-z |
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Components
#1: Protein | Mass: 19207.242 Da / Num. of mol.: 1 Source method: isolated from a genetically manipulated source Details: apc1167 / Source: (gene. exp.) ![]() ![]() ![]() ![]() |
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#2: Chemical | ChemComp-FMN / |
#3: Water | ChemComp-HOH / |
-Experimental details
-Experiment
Experiment | Method: ![]() |
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Sample preparation
Crystal | Density Matthews: 3.99 Å3/Da / Density % sol: 68.9 % |
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Crystal grow | Temperature: 293 K / Method: vapor diffusion, hanging drop / pH: 8 Details: trisodium citrate, sodium HEPES, sucrose, pH 7.5-8.5, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
-Data collection
Diffraction | Mean temperature: 150 K | ||||||||||||
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Diffraction source | Source: ![]() ![]() ![]() | ||||||||||||
Detector | Type: SBC-2 / Detector: CCD / Date: Aug 31, 2002 | ||||||||||||
Radiation | Monochromator: sagitally focused Si(111) / Protocol: MAD / Monochromatic (M) / Laue (L): M / Scattering type: x-ray | ||||||||||||
Radiation wavelength |
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Reflection | Resolution: 2.5→50 Å / Num. all: 22141 / Num. obs: 19743 / % possible obs: 89.2 % / Observed criterion σ(F): 1.5 / Observed criterion σ(I): 0 / Biso Wilson estimate: 38.1 Å2 / Limit h max: 40 / Limit h min: 0 / Limit k max: 23 / Limit k min: 0 / Limit l max: 36 / Limit l min: -36 / Observed criterion F max: 2577691.04 / Observed criterion F min: 3.489 |
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Processing
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Refinement | Method to determine structure: ![]()
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Solvent computation | Solvent model: CNS bulk solvent model used / Bsol: 50.1134 Å2 / ksol: 0.330555 e/Å3 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Displacement parameters | Biso max: 100.88 Å2 / Biso mean: 52.95 Å2 / Biso min: 29.36 Å2
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Refine analyze |
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Refinement step | Cycle: LAST / Resolution: 2.5→48.81 Å
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Refine LS restraints |
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LS refinement shell | Refine-ID: X-RAY DIFFRACTION
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