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Open data
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Basic information
Entry | Database: PDB / ID: 7w19 | ||||||
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Title | Crystal Structure of Acinetobacter baumannii MPH-E | ||||||
![]() | Macrolide 2'-phosphotransferase | ||||||
![]() | TRANSFERASE / Antibotic resistance | ||||||
Function / homology | Aminoglycoside phosphotransferase / Phosphotransferase enzyme family / transferase activity / GTP binding / Protein kinase-like domain superfamily / metal ion binding / Macrolide 2'-phosphotransferase![]() | ||||||
Biological species | ![]() | ||||||
Method | ![]() ![]() ![]() | ||||||
![]() | Qi, Q. / Kuang, L. / Jiang, Y. | ||||||
Funding support | ![]()
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![]() | ![]() Title: Crystal Structure of the Acinetobacter baumannii Macrolide Phosphotransferases E Reveal the Novel Catalysis Mechanism Authors: Qi, Q. / Kuang, L. / Jiang, Y. | ||||||
History |
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Structure visualization
Structure viewer | Molecule: ![]() ![]() |
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Downloads & links
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Download
PDBx/mmCIF format | ![]() | 310 KB | Display | ![]() |
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PDB format | ![]() | 208 KB | Display | ![]() |
PDBx/mmJSON format | ![]() | Tree view | ![]() | |
Others | ![]() |
-Validation report
Arichive directory | ![]() ![]() | HTTPS FTP |
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-Related structure data
Related structure data | ![]() 7w15C ![]() 7w1aC ![]() 5igjS S: Starting model for refinement C: citing same article ( |
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Similar structure data | Similarity search - Function & homology ![]() |
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Links
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Assembly
Deposited unit | ![]()
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1 | ![]()
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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
#1: Protein | Mass: 34619.586 Da / Num. of mol.: 2 Source method: isolated from a genetically manipulated source Source: (gene. exp.) ![]() ![]() ![]() #2: Chemical | #3: Chemical | ChemComp-MG / | #4: Water | ChemComp-HOH / | Has ligand of interest | Y | |
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-Experimental details
-Experiment
Experiment | Method: ![]() |
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Sample preparation
Crystal | Density Matthews: 2.06 Å3/Da / Density % sol: 40.17 % |
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Crystal grow | Temperature: 293.15 K / Method: vapor diffusion, hanging drop / pH: 5.7 Details: 0.1M Bis-Tris pH 5.7, 18% PEG 3350 (25% PEG 400 as cryoprotectant) |
-Data collection
Diffraction | Mean temperature: 100 K / Serial crystal experiment: N | ||||||||||||||||||||||||||||
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Diffraction source | Source: ![]() ![]() ![]() | ||||||||||||||||||||||||||||
Detector | Type: DECTRIS PILATUS3 6M / Detector: PIXEL / Date: Feb 5, 2021 | ||||||||||||||||||||||||||||
Radiation | Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray | ||||||||||||||||||||||||||||
Radiation wavelength | Wavelength: 0.973 Å / Relative weight: 1 | ||||||||||||||||||||||||||||
Reflection | Resolution: 1.88→50 Å / Num. obs: 45164 / % possible obs: 99.4 % / Redundancy: 10 % / Biso Wilson estimate: 23.88 Å2 / CC1/2: 0.997 / Rrim(I) all: 0.154 / Net I/σ(I): 4.61 | ||||||||||||||||||||||||||||
Reflection shell |
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Processing
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Refinement | Method to determine structure: ![]() Starting model: 5igj Resolution: 1.9→46.11 Å / SU ML: 0.2408 / Cross valid method: FREE R-VALUE / σ(F): 1.34 / Phase error: 27.8805 Stereochemistry target values: GeoStd + Monomer Library + CDL v1.2
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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 mean: 29.78 Å2 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Refinement step | Cycle: LAST / Resolution: 1.9→46.11 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: 19.8773436183 Å / Origin y: 35.1712995805 Å / Origin z: 10.0631492813 Å
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Refinement TLS group | Selection details: all |