+Open data
-Basic information
Entry | Database: PDB / ID: 6qer | ||||||
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Title | Apo Form Of ComR From S. Thermophilus in space group C2 | ||||||
Components | Transcriptional regulator | ||||||
Keywords | TRANSCRIPTION / Quorum sensing / Competence / TPR domain / HTH DNA binding domain | ||||||
Function / homology | Function and homology information | ||||||
Biological species | Streptococcus thermophilus (bacteria) | ||||||
Method | X-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.465 Å | ||||||
Authors | Thuillier, J. / Nessler, S. | ||||||
Citation | Journal: Proc.Natl.Acad.Sci.USA / Year: 2020 Title: Molecular dissection of pheromone selectivity in the competence signaling system ComRS of streptococci. Authors: Ledesma-Garcia, L. / Thuillier, J. / Guzman-Espinola, A. / Ensinck, I. / Li de la Sierra-Gallay, I. / Lazar, N. / Aumont-Nicaise, M. / Mignolet, J. / Soumillion, P. / Nessler, S. / Hols, P. | ||||||
History |
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-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Downloads & links
-Download
PDBx/mmCIF format | 6qer.cif.gz | 247.8 KB | Display | PDBx/mmCIF format |
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PDB format | pdb6qer.ent.gz | 202.4 KB | Display | PDB format |
PDBx/mmJSON format | 6qer.json.gz | Tree view | PDBx/mmJSON format | |
Others | Other downloads |
-Validation report
Summary document | 6qer_validation.pdf.gz | 460.3 KB | Display | wwPDB validaton report |
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Full document | 6qer_full_validation.pdf.gz | 479.6 KB | Display | |
Data in XML | 6qer_validation.xml.gz | 41.7 KB | Display | |
Data in CIF | 6qer_validation.cif.gz | 57.7 KB | Display | |
Arichive directory | https://data.pdbj.org/pub/pdb/validation_reports/qe/6qer ftp://data.pdbj.org/pub/pdb/validation_reports/qe/6qer | HTTPS FTP |
-Related structure data
Related structure data | 6hu8C 6huaC 5jufS 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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Unit cell |
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-Components
#1: Protein | Mass: 36547.996 Da / Num. of mol.: 4 Source method: isolated from a genetically manipulated source Details: cloning tag = GLGAGWSHPQFEK Source: (gene. exp.) Streptococcus thermophilus (strain ATCC BAA-491 / LMD-9) (bacteria) Strain: ATCC BAA-491 / LMD-9 / Gene: BN551_00358 / Production host: Escherichia coli BL21(DE3) (bacteria) / References: UniProt: A0A1L1QK15 #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: 2.59 Å3/Da / Density % sol: 52.55 % |
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Crystal grow | Temperature: 291.15 K / Method: vapor diffusion, sitting drop Details: 0.05M Magnesium acetate 10% PEG8000 0.1M Sodium acetate |
-Data collection
Diffraction | Mean temperature: 100 K / Serial crystal experiment: N |
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Diffraction source | Source: SYNCHROTRON / Site: SOLEIL / Beamline: PROXIMA 2 / Wavelength: 0.980105 Å |
Detector | Type: DECTRIS EIGER X 9M / Detector: PIXEL / Date: Apr 1, 2017 |
Radiation | Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray |
Radiation wavelength | Wavelength: 0.980105 Å / Relative weight: 1 |
Reflection | Resolution: 2.465→44.24 Å / Num. obs: 105306 / % possible obs: 99.59 % / Redundancy: 6.89 % / Rrim(I) all: 0.109 / Net I/σ(I): 14.34 |
Reflection shell | Resolution: 2.465→2.553 Å / Redundancy: 6.42 % / Mean I/σ(I) obs: 2.35 / Num. unique obs: 5173 / % possible all: 96.05 |
-Processing
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Refinement | Method to determine structure: MOLECULAR REPLACEMENT Starting model: 5JUF Resolution: 2.465→44.24 Å / SU ML: 0.35 / Cross valid method: NONE / σ(F): 1.36 / Phase error: 30.03
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Solvent computation | Shrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Refinement step | Cycle: LAST / Resolution: 2.465→44.24 Å
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Refine LS restraints |
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LS refinement shell |
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