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Yorodumi- PDB-5zwt: Crystal structure of the S37A mutant of apo-acyl carrier protein ... -
+Open data
-Basic information
Entry | Database: PDB / ID: 5zwt | ||||||
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Title | Crystal structure of the S37A mutant of apo-acyl carrier protein from Leishmania major | ||||||
Components | Acyl carrier protein | ||||||
Keywords | LIPID BINDING PROTEIN / Leishmania major / Acyl carrier protein / Fatty acid biosynthesis | ||||||
Function / homology | Function and homology information acyl binding / acyl carrier activity / mitochondrial respiratory chain complex I / fatty acid biosynthetic process / mitochondrial matrix / mitochondrion Similarity search - Function | ||||||
Biological species | Leishmania major (eukaryote) | ||||||
Method | X-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2 Å | ||||||
Authors | Sharma, B. / Arya, R. / Kundu, S. / Makde, R.D. | ||||||
Citation | Journal: Biochim Biophys Acta Proteins Proteom / Year: 2018 Title: A conformational switch from a closed apo- to an open holo-form equips the acyl carrier protein for acyl chain accommodation. Authors: Arya, R. / Sharma, B. / Dhembla, C. / Pal, R.K. / Patel, A.K. / Sundd, M. / Ghosh, B. / Makde, R.D. / Kundu, S. | ||||||
History |
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-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Downloads & links
-Download
PDBx/mmCIF format | 5zwt.cif.gz | 76.8 KB | Display | PDBx/mmCIF format |
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PDB format | pdb5zwt.ent.gz | 56.9 KB | Display | PDB format |
PDBx/mmJSON format | 5zwt.json.gz | Tree view | PDBx/mmJSON format | |
Others | Other downloads |
-Validation report
Arichive directory | https://data.pdbj.org/pub/pdb/validation_reports/zw/5zwt ftp://data.pdbj.org/pub/pdb/validation_reports/zw/5zwt | HTTPS FTP |
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-Related structure data
Related structure data | 5zwsC 1x3oS S: Starting model for refinement C: citing same article (ref.) |
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Similar structure data |
-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: 9271.485 Da / Num. of mol.: 2 / Mutation: S107A Source method: isolated from a genetically manipulated source Source: (gene. exp.) Leishmania major (eukaryote) / Gene: ACP, LMJF_27_0290 / Production host: Escherichia coli BL21(DE3) (bacteria) / References: UniProt: E9AD06 #2: 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: 2.34 Å3/Da / Density % sol: 47.45 % |
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Crystal grow | Temperature: 294 K / Method: microbatch / pH: 7.5 / Details: 0.1M HEPES, pH 7.5, 2.0M ammonium sulphate |
-Data collection
Diffraction | Mean temperature: 100 K |
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Diffraction source | Source: SYNCHROTRON / Site: RRCAT INDUS-2 / Beamline: PX-BL21 / Wavelength: 0.97949 Å |
Detector | Type: RAYONIX MX225HE / Detector: CCD / Date: Aug 27, 2015 |
Radiation | Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray |
Radiation wavelength | Wavelength: 0.97949 Å / Relative weight: 1 |
Reflection | Resolution: 2→41.75 Å / Num. obs: 11845 / % possible obs: 96.7 % / Redundancy: 10.6 % / CC1/2: 1 / Rmerge(I) obs: 0.065 / Rpim(I) all: 0.021 / Net I/σ(I): 21.7 |
Reflection shell | Resolution: 2→2.05 Å / Redundancy: 10.9 % / Rmerge(I) obs: 0.956 / Num. unique obs: 886 / CC1/2: 0.819 / Rpim(I) all: 0.303 / % possible all: 100 |
-Processing
Software |
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Refinement | Method to determine structure: MOLECULAR REPLACEMENT Starting model: 1X3O Resolution: 2→31.993 Å / SU ML: 0.17 / Cross valid method: FREE R-VALUE / σ(F): 1.34 / Phase error: 29.4
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Solvent computation | Shrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å | ||||||||||||||||||||||||||||||||||||||||
Refinement step | Cycle: LAST / Resolution: 2→31.993 Å
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Refine LS restraints |
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LS refinement shell |
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Refinement TLS params. | Method: refined / Origin x: -24.7773 Å / Origin y: -2.0873 Å / Origin z: -25.8077 Å
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Refinement TLS group | Selection details: all |