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- PDB-1tcj: STRUCTURE-ACTIVITY RELATIONSHIPS OF MU-CONOTOXIN GIIIA: STRUCTURE... -

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Entry
Database: PDB / ID: 1tcj
TitleSTRUCTURE-ACTIVITY RELATIONSHIPS OF MU-CONOTOXIN GIIIA: STRUCTURE DETERMINATION OF ACTIVE AND INACTIVE SODIUM CHANNEL BLOCKER PEPTIDES BY NMR AND SIMULATED ANNEALING CALCULATIONS
ComponentsMU-CONOTOXIN GIIIA
KeywordsNEUROTOXIN
Function / homologyMu-Conotoxin / Conotoxin, mu-type / Mu-conotoxin family signature. / sodium channel inhibitor activity / toxin activity / extracellular region / Mu-conotoxin GIIIA
Function and homology information
Biological speciesConus geographus (geography cone)
MethodSOLUTION NMR
AuthorsKohda, D. / Lancelin, J.-M. / Inagaki, F. / Wakamatsu, K.
Citation
Journal: Biochemistry / Year: 1992
Title: Structure-activity relationships of mu-conotoxin GIIIA: structure determination of active and inactive sodium channel blocker peptides by NMR and simulated annealing calculations.
Authors: Wakamatsu, K. / Kohda, D. / Hatanaka, H. / Lancelin, J.M. / Ishida, Y. / Oya, M. / Nakamura, H. / Inagaki, F. / Sato, K.
#1: Journal: Biochemistry / Year: 1991
Title: Tertiary Structure of Conotoxin Giiia in Aqueous Solution
Authors: Lancelin, J.-M. / Kohda, D. / Tate, S.-I. / Yanagawa, Y. / Abe, T. / Satake, M. / Inagaki, F.
#2: Journal: J.Biol.Chem. / Year: 1991
Title: Active Site of Mu-Conotoxin Giiia, a Peptide Blocker of Muscle Sodium Channels
Authors: Sato, K. / Ishida, Y. / Wakamatsu, K. / Kato, R. / Honda, H. / Ohizumi, Y. / Nakamura, H. / Ohya, M. / Lancelin, J.-M. / Kohda, D. / Inagaki, F.
History
DepositionDec 12, 1992Processing site: BNL
Revision 1.0Jan 31, 1994Provider: repository / Type: Initial release
Revision 1.1Mar 24, 2008Group: Version format compliance
Revision 1.2Jul 13, 2011Group: Version format compliance
Revision 1.3Nov 29, 2017Group: Derived calculations / Other
Category: pdbx_database_status / pdbx_struct_assembly ...pdbx_database_status / pdbx_struct_assembly / pdbx_struct_oper_list / struct_conf / struct_conf_type
Item: _pdbx_database_status.process_site

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Assembly

Deposited unit
A: MU-CONOTOXIN GIIIA


Theoretical massNumber of molelcules
Total (without water)2,6211
Polymers2,6211
Non-polymers00
Water00
1


  • Idetical with deposited unit
  • defined by author
TypeNameSymmetry operationNumber
identity operation1_5551
Atom site foot note1: RESIDUE HYP 7 IS A CIS HYDROXYPROLINE. / 2: THE C-TERMINAL CARBOXYLATE IS AMIDATED.
NMR ensembles
DataCriteria
Number of conformers (submitted / calculated)10 / -
Representative

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Components

#1: Protein/peptide MU-CONOTOXIN GIIIA


Mass: 2621.139 Da / Num. of mol.: 1
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Conus geographus (geography cone) / References: UniProt: P01523

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Experimental details

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Experiment

ExperimentMethod: SOLUTION NMR

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Processing

NMR softwareName: X-PLOR / Version: 2.1 / Developer: BRUNGER / Classification: refinement
NMR ensembleConformers submitted total number: 10

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