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Open data
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Basic information
Entry | Database: PDB / ID: 6mw2 | ||||||
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Title | cyclo-Mle-Phe-Mle-D-Phe. D-Phe analogue of pseudoxylallemycin A. | ||||||
![]() | pseudoxylallemycin A | ||||||
![]() | ANTIBIOTIC / tetrapeptide / cyclic peptide / N-methyl leucine / analogue of pseudoxylallemycin A | ||||||
Function / homology | cyclo-Mle-Phe-Mle-D-Phe. D-Phe analogue of pseudoxylallemycin A![]() | ||||||
Biological species | ![]() | ||||||
Method | ![]() ![]() | ||||||
![]() | Cameron, A.J. / Harris, P.W.R. / Brimble, M.A. / Squire, C.J. | ||||||
![]() | ![]() Title: Investigations of the key macrolactamisation step in the synthesis of cyclic tetrapeptide pseudoxylallemycin A. Authors: Cameron, A.J. / Squire, C.J. / Gerenton, A. / Stubbing, L.A. / Harris, P.W.R. / Brimble, M.A. | ||||||
History |
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Structure visualization
Structure viewer | Molecule: ![]() ![]() |
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Downloads & links
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Download
PDBx/mmCIF format | ![]() | 8.4 KB | Display | ![]() |
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PDB format | ![]() | 5.3 KB | Display | ![]() |
PDBx/mmJSON format | ![]() | Tree view | ![]() | |
Others | ![]() |
-Validation report
Arichive directory | ![]() ![]() | HTTPS FTP |
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-Related structure data
Related structure data | ![]() 6mvzC ![]() 6mw0C ![]() 6mw1C 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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Unit cell |
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Components
#1: Protein/peptide | |
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-Experimental details
-Experiment
Experiment | Method: ![]() |
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Sample preparation
Crystal | Density Matthews: 1.34 Å3/Da / Density % sol: 8.1 % |
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Crystal grow | Temperature: 293 K / Method: evaporation / Details: methanol, ethanol, tetrahydrofuran, water |
-Data collection
Diffraction | Mean temperature: 100 K / Serial crystal experiment: N |
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Diffraction source | Source: ![]() ![]() ![]() |
Detector | Type: DECTRIS EIGER X 16M / Detector: PIXEL / Date: Jul 13, 2018 |
Radiation | Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray |
Radiation wavelength | Wavelength: 0.71075 Å / Relative weight: 1 |
Reflection | Resolution: 0.77→20.49 Å / Num. obs: 3920 / % possible obs: 99.5 % / Redundancy: 11.4 % / CC1/2: 0.999 / Rmerge(I) obs: 0.042 / Rpim(I) all: 0.013 / Net I/σ(I): 32.1 |
Reflection shell | Resolution: 0.77→0.79 Å / Redundancy: 9.5 % / Rmerge(I) obs: 0.093 / Mean I/σ(I) obs: 19.1 / Num. unique obs: 290 / CC1/2: 0.992 / Rpim(I) all: 0.034 / % possible all: 95.1 |
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Processing
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Refinement | Method to determine structure: AB INITIO PHASING / Resolution: 0.77→20.49 Å / Cross valid method: NONE Details: Full least squares refinement in SHELXL with anisotropic atomic displacement parameters and riding hydrogens.
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Refinement step | Cycle: LAST / Resolution: 0.77→20.49 Å /
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