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Open data
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Basic information
Entry | Database: PDB / ID: 2n7o | ||||||
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Title | NMR Structure of Peptide PG-990 in DPC micelles | ||||||
![]() | Peptide PG-990 | ||||||
![]() | DE NOVO PROTEIN | ||||||
Biological species | synthetic construct (others) | ||||||
Method | SOLUTION NMR / simulated annealing | ||||||
Model details | lowest energy, model50 | ||||||
![]() | Carotenuto, A. / Merlino, F. / Chai, M. / Brancaccio, D. / Yousif, A. / Novellino, E. / Hruby, V. / Grieco, P. | ||||||
![]() | ![]() Title: Discovery of Novel Potent and Selective Agonists at the Melanocortin-3 Receptor. Authors: Carotenuto, A. / Merlino, F. / Cai, M. / Brancaccio, D. / Yousif, A.M. / Novellino, E. / Hruby, V.J. / Grieco, P. | ||||||
History |
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Structure visualization
Structure viewer | Molecule: ![]() ![]() |
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Downloads & links
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Download
PDBx/mmCIF format | ![]() | 31.8 KB | Display | ![]() |
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PDB format | ![]() | 24.5 KB | Display | ![]() |
PDBx/mmJSON format | ![]() | Tree view | ![]() | |
Others | ![]() |
-Validation report
Summary document | ![]() | 361.6 KB | Display | ![]() |
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Full document | ![]() | 369.6 KB | Display | |
Data in XML | ![]() | 4.3 KB | Display | |
Data in CIF | ![]() | 5.1 KB | Display | |
Arichive directory | ![]() ![]() | HTTPS FTP |
-Related structure data
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Links
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Assembly
Deposited unit | ![]()
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NMR ensembles |
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Components
#1: Protein/peptide | Mass: 1134.352 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.) synthetic construct (others) |
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-Experimental details
-Experiment
Experiment | Method: SOLUTION NMR | ||||||||||||||||
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NMR experiment |
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Sample preparation
Details | Contents: 2 mM PG, 200 mM [U-2H] DPC, 90% H2O/10% D2O / Solvent system: 90% H2O/10% D2O | ||||||||||||
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Sample |
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Sample conditions | Ionic strength: 10 / pH: 5.5 / Pressure: ambient / Temperature: 298.0 K |
-NMR measurement
NMR spectrometer | Type: Varian INOVA / Manufacturer: Varian / Model: INOVA / Field strength: 700 MHz |
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Processing
NMR software |
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Refinement | Method: simulated annealing / Software ordinal: 1 | ||||||||||||
NMR representative | Selection criteria: lowest energy | ||||||||||||
NMR ensemble | Conformer selection criteria: back calculated data agree with experimental NOESY spectrum Conformers calculated total number: 100 / Conformers submitted total number: 10 |