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Open data
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Basic information
Entry | Database: PDB / ID: 6xrw | ||||||
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Title | Chromosomal ParDE TA system from P. aeruginosa | ||||||
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![]() | TOXIN/ANTITOXIN / toxin antitoxin system / ParE toxin ParD antitoxin type II TA system / TOXIN / TOXIN-ANTITOXIN complex | ||||||
Function / homology | ![]() | ||||||
Biological species | ![]() ![]() | ||||||
Method | ![]() ![]() | ||||||
![]() | Bourne, C.R. / Snead, K.J. / Thomas, L.M. | ||||||
Funding support | ![]()
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![]() | ![]() Title: ParD Antitoxin Hotspot Alters a Disorder-to-Order Transition upon Binding to Its Cognate ParE Toxin, Lessening Its Interaction Affinity and Increasing Its Protease Degradation Kinetics. Authors: Snead, K.J. / Moore, L.L. / Bourne, C.R. | ||||||
History |
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Structure visualization
Structure viewer | Molecule: ![]() ![]() |
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Downloads & links
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Download
PDBx/mmCIF format | ![]() | 95.2 KB | Display | ![]() |
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PDB format | ![]() | 70.2 KB | Display | ![]() |
PDBx/mmJSON format | ![]() | Tree view | ![]() | |
Others | ![]() |
-Validation report
Summary document | ![]() | 642.9 KB | Display | ![]() |
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Full document | ![]() | 650.1 KB | Display | |
Data in XML | ![]() | 21 KB | Display | |
Data in CIF | ![]() | 30 KB | Display | |
Arichive directory | ![]() ![]() | HTTPS FTP |
-Related structure data
Related structure data | ![]() 5czeS S: Starting model for refinement |
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Similar structure data |
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Links
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Assembly
Deposited unit | ![]()
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2 | ![]()
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Unit cell |
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Components on special symmetry positions |
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Components
-Protein , 2 types, 4 molecules ACBD
#1: Protein | Mass: 10890.642 Da / Num. of mol.: 2 Source method: isolated from a genetically manipulated source Source: (gene. exp.) ![]() ![]() Gene: ALP65_02189, C0044_00935, CAZ10_15820, CGU42_21595, DT376_01585, DZ962_27795, ECC04_014080, F3H14_16060, F6X67_25435, F7O92_13145, F8137_22785, FC629_00725, FDK04_00710, FEM29_10625, FZE40_ ...Gene: ALP65_02189, C0044_00935, CAZ10_15820, CGU42_21595, DT376_01585, DZ962_27795, ECC04_014080, F3H14_16060, F6X67_25435, F7O92_13145, F8137_22785, FC629_00725, FDK04_00710, FEM29_10625, FZE40_26955, FZE44_21675, FZE49_19155, GEZ68_19720, GNQ12_20765, GNQ27_19805, GNQ36_15570, GNQ40_21605, GNQ44_11770, GNQ48_08755, GNQ66_20720, GRH68_21070, GRH69_08580, IPC36_01505, IPC669_21920, NCTC10662_01006, NCTC11839_02383, NCTC13621_04834, PaeAG1_00136, RW109_RW109_00727 Plasmid: pET15b / Production host: ![]() ![]() #2: Protein | Mass: 8994.097 Da / Num. of mol.: 2 Source method: isolated from a genetically manipulated source Source: (gene. exp.) ![]() ![]() Gene: DY930_22595, E4V10_10535, F7O96_16600, GNQ12_20760, IPC1509_05415, IPC584_11760, NCTC10299_03548, NCTC12934_01716, PAMH19_0124, PA0125 Production host: ![]() ![]() |
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-Non-polymers , 4 types, 425 molecules ![](data/chem/img/GOL.gif)
![](data/chem/img/2PE.gif)
![](data/chem/img/BEN.gif)
![](data/chem/img/HOH.gif)
![](data/chem/img/2PE.gif)
![](data/chem/img/BEN.gif)
![](data/chem/img/HOH.gif)
#3: Chemical | ChemComp-GOL / #4: Chemical | ChemComp-2PE / | #5: Chemical | ChemComp-BEN / | #6: Water | ChemComp-HOH / | |
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-Details
Has ligand of interest | N |
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-Experimental details
-Experiment
Experiment | Method: ![]() |
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Sample preparation
Crystal | Density Matthews: 2.2 Å3/Da / Density % sol: 44.05 % |
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Crystal grow | Temperature: 293 K / Method: vapor diffusion, sitting drop Details: 1:1 mixture of precipitant 7.5% MPD, 20% PEG 6000, 25 mM (NH4)2SO4, 100 mM Tris pH 7.0 with protein solution 10.5 mg/mL ParDE in 25 mM MES pH 6.0, 150 mM NaCl, 2.5% glycerol |
-Data collection
Diffraction | Mean temperature: 100 K / Serial crystal experiment: N | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
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Diffraction source | Source: ![]() | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Detector | Type: DECTRIS PILATUS 200K / Detector: PIXEL / Date: Jul 25, 2019 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Radiation | Monochromator: M / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Radiation wavelength | Wavelength: 1.54 Å / Relative weight: 1 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Reflection | Resolution: 1.77→50 Å / Num. obs: 33497 / % possible obs: 99.6 % / Redundancy: 5.1 % / Rmerge(I) obs: 0.048 / Rpim(I) all: 0.022 / Rrim(I) all: 0.054 / Χ2: 0.798 / Net I/σ(I): 12.8 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Reflection shell | Diffraction-ID: 1
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Processing
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Refinement | Method to determine structure: ![]() Starting model: 5CZE Resolution: 1.77→27.86 Å / SU ML: 0.21 / Cross valid method: THROUGHOUT / σ(F): 1.33 / Phase error: 21.68 / Stereochemistry target values: ML
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Solvent computation | Shrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å / Solvent model: FLAT BULK SOLVENT MODEL | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Displacement parameters | Biso max: 72.28 Å2 / Biso mean: 24.1216 Å2 / Biso min: 5.95 Å2 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Refinement step | Cycle: final / Resolution: 1.77→27.86 Å
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LS refinement shell | Refine-ID: X-RAY DIFFRACTION / Rfactor Rfree error: 0 / Total num. of bins used: 14
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