+Open data
-Basic information
Entry | Database: PDB / ID: 1kdj | ||||||
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Title | OXIDIZED FORM OF PLASTOCYANIN FROM DRYOPTERIS CRASSIRHIZOMA | ||||||
Components | PLASTOCYANIN | ||||||
Keywords | ELECTRON TRANSFER / PHOTOSYSTEM / PAI-PAI STACKING | ||||||
Function / homology | Function and homology information electron transporter, transferring electrons from cytochrome b6/f complex of photosystem II activity / chloroplast thylakoid lumen / chloroplast thylakoid membrane / copper ion binding Similarity search - Function | ||||||
Biological species | Adiantum capillus-veneris (maidenhair fern) | ||||||
Method | X-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 1.7 Å | ||||||
Authors | Inoue, T. / Gotowda, M. / Hamada, K. / Kohzuma, T. / Yoshizaki, F. / Sugimura, Y. / Kai, Y. | ||||||
Citation | Journal: J.Biol.Chem. / Year: 1999 Title: The structure and unusual pH dependence of plastocyanin from the fern Dryopteris crassirhizoma. The protonation of an active site histidine is hindered by pi-pi interactions. Authors: Kohzuma, T. / Inoue, T. / Yoshizaki, F. / Sasakawa, Y. / Onodera, K. / Nagatomo, S. / Kitagawa, T. / Uzawa, S. / Isobe, Y. / Sugimura, Y. / Gotowda, M. / Kai, Y. | ||||||
History |
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-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Downloads & links
-Download
PDBx/mmCIF format | 1kdj.cif.gz | 31.3 KB | Display | PDBx/mmCIF format |
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PDB format | pdb1kdj.ent.gz | 20.9 KB | Display | PDB format |
PDBx/mmJSON format | 1kdj.json.gz | Tree view | PDBx/mmJSON format | |
Others | Other downloads |
-Validation report
Summary document | 1kdj_validation.pdf.gz | 358.7 KB | Display | wwPDB validaton report |
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Full document | 1kdj_full_validation.pdf.gz | 359.9 KB | Display | |
Data in XML | 1kdj_validation.xml.gz | 3.2 KB | Display | |
Data in CIF | 1kdj_validation.cif.gz | 4.8 KB | Display | |
Arichive directory | https://data.pdbj.org/pub/pdb/validation_reports/kd/1kdj ftp://data.pdbj.org/pub/pdb/validation_reports/kd/1kdj | HTTPS FTP |
-Related structure data
-Links
-Assembly
Deposited unit |
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1 |
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Unit cell |
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-Components
#1: Protein | Mass: 10785.973 Da / Num. of mol.: 1 / Source method: isolated from a natural source / Details: OXIDIZED Source: (natural) Adiantum capillus-veneris (maidenhair fern) References: UniProt: Q7SIB8 |
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#2: Chemical | ChemComp-CU / |
#3: Water | ChemComp-HOH / |
-Experimental details
-Experiment
Experiment | Method: X-RAY DIFFRACTION / Number of used crystals: 1 |
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-Sample preparation
Crystal | Density Matthews: 2.4 Å3/Da / Density % sol: 48 % | ||||||||||||||||||||||||||||||
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Crystal grow | pH: 4.5 / Details: pH 4.5 | ||||||||||||||||||||||||||||||
Crystal | *PLUS Density % sol: 49 % | ||||||||||||||||||||||||||||||
Crystal grow | *PLUS Temperature: 20 ℃ / Method: vapor diffusion, hanging drop | ||||||||||||||||||||||||||||||
Components of the solutions | *PLUS
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-Data collection
Diffraction | Mean temperature: 298 K |
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Diffraction source | Source: SYNCHROTRON / Site: Photon Factory / Beamline: BL-6B / Wavelength: 1 |
Detector | Type: WEISSENBERG / Detector: DIFFRACTOMETER / Date: Feb 20, 1996 |
Radiation | Monochromator: SI(111) / Monochromatic (M) / Laue (L): M / Scattering type: x-ray |
Radiation wavelength | Wavelength: 1 Å / Relative weight: 1 |
Reflection | Resolution: 1.7→30 Å / Num. obs: 10063 / % possible obs: 95 % / Observed criterion σ(I): 2 / Redundancy: 9.2 % / Rmerge(I) obs: 0.05 / Net I/σ(I): 9.1 |
Reflection shell | Resolution: 1.7→1.76 Å / Rmerge(I) obs: 0.148 / Mean I/σ(I) obs: 2.45 / % possible all: 83.3 |
Reflection | *PLUS Num. obs: 10220 / % possible obs: 96 % / Num. measured all: 69003 / Rmerge(I) obs: 0.089 |
-Processing
Software |
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Refinement | Method to determine structure: MOLECULAR REPLACEMENT Starting model: POPLAR PLASTOCYANIN Resolution: 1.7→6 Å / Data cutoff low absF: 0 / σ(F): 2
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Refine analyze | Luzzati coordinate error obs: 0.2 Å | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Refinement step | Cycle: LAST / Resolution: 1.7→6 Å
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Refine LS restraints |
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LS refinement shell | Resolution: 1.7→1.78 Å / Total num. of bins used: 8
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Software | *PLUS Name: X-PLOR / Version: 3 / Classification: refinement | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Refinement | *PLUS Num. reflection obs: 9943 / Rfactor obs: 0.241 / Rfactor Rfree: 0.288 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Solvent computation | *PLUS | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Displacement parameters | *PLUS | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Refine LS restraints | *PLUS
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LS refinement shell | *PLUS Rfactor Rwork: 0.34 |