+Open data
-Basic information
Entry | Database: PDB / ID: 1c8w | ||||||
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Title | THR45GLY VARIANT OF RIBONUCLEASE A | ||||||
Components | PROTEIN (Ribonuclease A) | ||||||
Keywords | HYDROLASE / ANTI-PARALLEL BETA SHEET / RNASE A | ||||||
Function / homology | Function and homology information pancreatic ribonuclease / ribonuclease A activity / RNA nuclease activity / nucleic acid binding / lyase activity / defense response to Gram-positive bacterium / extracellular region Similarity search - Function | ||||||
Biological species | Bos taurus (cattle) | ||||||
Method | X-RAY DIFFRACTION / Resolution: 1.8 Å | ||||||
Authors | Kelemen, B.R. / Sweeney, R.T. / Schultz, L.W. / Raines, R.T. | ||||||
Citation | Journal: Biochemistry / Year: 2000 Title: Excavating an active site: the nucleobase specificity of ribonuclease A. Authors: Kelemen, B.R. / Schultz, L.W. / Sweeney, R.Y. / Raines, R.T. | ||||||
History |
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-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Downloads & links
-Download
PDBx/mmCIF format | 1c8w.cif.gz | 35.2 KB | Display | PDBx/mmCIF format |
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PDB format | pdb1c8w.ent.gz | 26.8 KB | Display | PDB format |
PDBx/mmJSON format | 1c8w.json.gz | Tree view | PDBx/mmJSON format | |
Others | Other downloads |
-Validation report
Arichive directory | https://data.pdbj.org/pub/pdb/validation_reports/c8/1c8w ftp://data.pdbj.org/pub/pdb/validation_reports/c8/1c8w | 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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Components on special symmetry positions |
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-Components
#1: Protein | Mass: 13664.273 Da / Num. of mol.: 1 / Fragment: RNASE A / Mutation: T45G Source method: isolated from a genetically manipulated source Source: (gene. exp.) Bos taurus (cattle) / Organ: pancreas / Plasmid: pET22b+ / Production host: Escherichia coli (E. coli) / References: UniProt: P61823 | ||
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#2: Chemical | ChemComp-ACT / | ||
#3: Chemical | #4: 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: 2.83 Å3/Da / Density % sol: 56.58 % | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||
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Crystal grow | Temperature: 293 K / Method: vapor diffusion, hanging drop / pH: 5.6 Details: Ammonium sulfate, sodium chloride, sodium acetate, pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 293K | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Crystal grow | *PLUS Temperature: 20 ℃ | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Components of the solutions | *PLUS
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-Data collection
Diffraction | Mean temperature: 275 K |
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Diffraction source | Source: ROTATING ANODE / Type: RIGAKU RU200 / Wavelength: 1.5418 |
Detector | Type: SIEMENS HI-STAR / Detector: AREA DETECTOR / Date: Oct 8, 1995 |
Radiation | Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray |
Radiation wavelength | Wavelength: 1.5418 Å / Relative weight: 1 |
Reflection | Resolution: 1.8→30 Å / Num. all: 18836 / Num. obs: 18761 / % possible obs: 96 % / Observed criterion σ(F): 0.33 / Observed criterion σ(I): 0.33 / Redundancy: 3.3 % / Rmerge(I) obs: 0.036 / Net I/σ(I): 23.2 |
Reflection shell | Resolution: 1.8→1.9 Å / Redundancy: 1.9 % / Rmerge(I) obs: 0.19 / Num. unique all: 18761 / % possible all: 87 |
Reflection | *PLUS Num. measured all: 32164 |
Reflection shell | *PLUS % possible obs: 87 % |
-Processing
Software |
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Refinement | Resolution: 1.8→30 Å / σ(F): 0.33 / σ(I): 0.33
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Solvent computation | Bsol: 265.25 Å2 / ksol: 0.90215 e/Å3 | ||||||||||||||||||||||||||||||||||||||||
Refinement step | Cycle: LAST / Resolution: 1.8→30 Å
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Refine LS restraints |
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Refinement | *PLUS Rfactor obs: 0.176 | ||||||||||||||||||||||||||||||||||||||||
Solvent computation | *PLUS | ||||||||||||||||||||||||||||||||||||||||
Displacement parameters | *PLUS | ||||||||||||||||||||||||||||||||||||||||
Refine LS restraints | *PLUS
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