+Open data
-Basic information
Entry | Database: PDB / ID: 2jtu | ||||||
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Title | NMR structure of iota-RXIA(38) | ||||||
Components | I-superfamily conotoxin r11a | ||||||
Keywords | TOXIN / iota-RXIA / Bromination / D-amino acid / Hydroxylation / Neurotoxin / Secreted | ||||||
Function / homology | Conotoxin I-superfamily / Conotoxin I-superfamily / Conotoxin-I, conserved site / I-superfamily conotoxin signature. / sodium channel regulator activity / toxin activity / extracellular region / Iota-conotoxin RXIA Function and homology information | ||||||
Method | SOLUTION NMR / simulated annealing | ||||||
Authors | Wei, D. / Norton, R. | ||||||
Citation | Journal: To be Published Title: NMR structure of iota-RXIA(38) Authors: Wei, D. / Norton, R. | ||||||
History |
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-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Downloads & links
-Download
PDBx/mmCIF format | 2jtu.cif.gz | 206.2 KB | Display | PDBx/mmCIF format |
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PDB format | pdb2jtu.ent.gz | 179 KB | Display | PDB format |
PDBx/mmJSON format | 2jtu.json.gz | Tree view | PDBx/mmJSON format | |
Others | Other downloads |
-Validation report
Arichive directory | https://data.pdbj.org/pub/pdb/validation_reports/jt/2jtu ftp://data.pdbj.org/pub/pdb/validation_reports/jt/2jtu | HTTPS FTP |
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-Related structure data
Similar structure data |
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-Links
-Assembly
Deposited unit |
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1 |
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NMR ensembles |
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-Components
#1: Protein/peptide | Mass: 4088.646 Da / Num. of mol.: 1 / Source method: obtained synthetically / References: UniProt: Q7Z094 |
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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: 0.6 mM iota-RXIA, 95% H2O/5% D2O / Solvent system: 95% H2O/5% D2O |
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Sample | Conc.: 0.6 mM / Component: iota-RXIA |
Sample conditions | pH: 5.9 / Pressure: ambient / Temperature: 298 K |
-NMR measurement
NMR spectrometer | Type: Bruker DRX / Manufacturer: Bruker / Model: DRX / Field strength: 600 MHz |
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-Processing
NMR software | Name: CNS / Developer: Brunger A. T. et.al. / Classification: refinement |
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Refinement | Method: simulated annealing / Software ordinal: 1 |
NMR representative | Selection criteria: lowest energy |
NMR ensemble | Conformer selection criteria: structures with the lowest energy Conformers calculated total number: 100 / Conformers submitted total number: 20 |