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Yorodumi- PDB-1coz: CTP:GLYCEROL-3-PHOSPHATE CYTIDYLYLTRANSFERASE FROM BACILLUS SUBTILIS -
+Open data
-Basic information
Entry | Database: PDB / ID: 1coz | ||||||
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Title | CTP:GLYCEROL-3-PHOSPHATE CYTIDYLYLTRANSFERASE FROM BACILLUS SUBTILIS | ||||||
Components | PROTEIN (GLYCEROL-3-PHOSPHATE CYTIDYLYLTRANSFERASE) | ||||||
Keywords | TRANSFERASE | ||||||
Function / homology | Function and homology information glycerol-3-phosphate cytidylyltransferase / glycerol-3-phosphate cytidylyltransferase activity / teichoic acid biosynthetic process / cell wall organization / metal ion binding / cytoplasm Similarity search - Function | ||||||
Biological species | Bacillus subtilis (bacteria) | ||||||
Method | X-RAY DIFFRACTION / MAD / Resolution: 2 Å | ||||||
Authors | Weber, C.H. / Park, Y.S. / Sanker, S. / Kent, C. / Ludwig, M.L. | ||||||
Citation | Journal: Structure Fold.Des. / Year: 1999 Title: A prototypical cytidylyltransferase: CTP:glycerol-3-phosphate cytidylyltransferase from bacillus subtilis. Authors: Weber, C.H. / Park, Y.S. / Sanker, S. / Kent, C. / Ludwig, M.L. | ||||||
History |
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-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Downloads & links
-Download
PDBx/mmCIF format | 1coz.cif.gz | 68.4 KB | Display | PDBx/mmCIF format |
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PDB format | pdb1coz.ent.gz | 50.9 KB | Display | PDB format |
PDBx/mmJSON format | 1coz.json.gz | Tree view | PDBx/mmJSON format | |
Others | Other downloads |
-Validation report
Arichive directory | https://data.pdbj.org/pub/pdb/validation_reports/co/1coz ftp://data.pdbj.org/pub/pdb/validation_reports/co/1coz | HTTPS FTP |
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-Related structure data
Similar structure data |
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-Links
-Assembly
Deposited unit |
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1 |
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Unit cell |
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Noncrystallographic symmetry (NCS) | NCS domain:
NCS oper: (Code: given Matrix: (0.9844, 0.1749, 0.0366), Vector: |
-Components
#1: Protein | Mass: 15295.539 Da / Num. of mol.: 2 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Bacillus subtilis (bacteria) / Strain: BR151-ESC168 / Plasmid: PET-11A / Production host: Escherichia coli (E. coli) References: UniProt: P27623, glycerol-3-phosphate cytidylyltransferase #2: Chemical | #3: 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: 2.3 Å3/Da / Density % sol: 48 % | ||||||||||||||||||||||||||||||||||||||||||||||||||
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Crystal grow | pH: 8.5 Details: 100 MM TRIS PH 8.5 200 MM LITHIUM SULFATE 30% PEG 3350 (BAKER) | ||||||||||||||||||||||||||||||||||||||||||||||||||
Crystal | *PLUS | ||||||||||||||||||||||||||||||||||||||||||||||||||
Crystal grow | *PLUS Temperature: 4 ℃ / Method: vapor diffusion, hanging drop | ||||||||||||||||||||||||||||||||||||||||||||||||||
Components of the solutions | *PLUS
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-Data collection
Diffraction | Mean temperature: 277 K |
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Diffraction source | Source: ROTATING ANODE / Type: RIGAKU RU200 / Wavelength: 1.5418 |
Detector | Type: SDMS / Detector: AREA DETECTOR |
Radiation | Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray |
Radiation wavelength | Wavelength: 1.5418 Å / Relative weight: 1 |
Reflection | Resolution: 2→100 Å / Num. obs: 16917 / % possible obs: 88.6 % / Redundancy: 2.68 % / Biso Wilson estimate: 24.7 Å2 / Rsym value: 0.061 |
Reflection shell | Resolution: 2→2.12 Å / Rsym value: 0.125 / % possible all: 66.4 |
Reflection | *PLUS Num. measured all: 45342 / Rmerge(I) obs: 0.061 |
Reflection shell | *PLUS % possible obs: 83.8 % / Rmerge(I) obs: 0.125 |
-Processing
Software |
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Refinement | Method to determine structure: MAD / Resolution: 2→8 Å / Rfactor Rfree error: 0.006 / Data cutoff high absF: 100000 / Data cutoff low absF: 0.001 / Isotropic thermal model: RESTRAINED / Cross valid method: A POSTERIORI / σ(F): 0 Details: BULK SOLVENT MODEL USED GROUP 1 FOR NCS RESTRAINTS: 1 - 37 AND 501 - 537, 47 - 73 AND 547 - 573, 76 - 81 AND 576 - 581, 88 - 93 AND 588 - 593, AND 108 - 126 AND 608 - 626. THE REMAINDER OF ...Details: BULK SOLVENT MODEL USED GROUP 1 FOR NCS RESTRAINTS: 1 - 37 AND 501 - 537, 47 - 73 AND 547 - 573, 76 - 81 AND 576 - 581, 88 - 93 AND 588 - 593, AND 108 - 126 AND 608 - 626. THE REMAINDER OF THE PROTEIN ATOMS WERE IN GROUP 2. THIS P 21 CRYSTAL DISPLAYS MEROHEDRAL TWINNING AND CAN BE INDEXED AS ORTHORHOMBIC C 2 2 21
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Displacement parameters | Biso mean: 25.2 Å2
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Refine analyze |
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Refinement step | Cycle: LAST / Resolution: 2→8 Å
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Refine LS restraints |
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Refine LS restraints NCS |
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LS refinement shell | Resolution: 2→2.12 Å / Rfactor Rfree error: 0.021 / Total num. of bins used: 6
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Xplor file |
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Software | *PLUS Name: X-PLOR / Version: 3.851 / Classification: refinement | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Refinement | *PLUS σ(F): 0 / % reflection Rfree: 10 % | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Solvent computation | *PLUS | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Displacement parameters | *PLUS Biso mean: 25.2 Å2 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Refine LS restraints | *PLUS
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LS refinement shell | *PLUS Rfactor Rfree: 0.302 / % reflection Rfree: 10.5 % / Rfactor Rwork: 0.271 |