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- PDB-1csa: THE MUTANT E.COLI F112W CYCLOPHILIN BINDS CYCLOSPORIN A IN NEARLY... -

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Entry
Database: PDB / ID: 1csa
TitleTHE MUTANT E.COLI F112W CYCLOPHILIN BINDS CYCLOSPORIN A IN NEARLY IDENTICAL CONFORMATION AS HUMAN CYCLOPHILIN
ComponentsCYCLOSPORIN ACiclosporin
KeywordsIMMUNOSUPPRESSANT / CYCLOSPORIN A
Function / homologyCyclosporin A / :
Function and homology information
Biological speciesTOLYPOCLADIUM INFLATUM (fungus)
MethodSOLUTION NMR
AuthorsFejzo, J. / Walsh, C.T. / Wagner, G.
Citation
Journal: Biochemistry / Year: 1994
Title: The Mutant Escherichia Coli F112W Cyclophilin Binds Cyclosporin a in Nearly Identical Conformation as Human Cyclophilin.
Authors: Fejzo, J. / Etzkorn, F.A. / Clubb, R.T. / Shi, Y. / Walsh, C.T. / Wagner, G.
#1: Journal: Biochemistry / Year: 1994
Title: Three-Dimensional Solution Structure of Escherichia Coli Periplasmic Cyclophilin.
Authors: Clubb, R.T. / Ferguson, S.B. / Walsh, C.T. / Wagner, G.
History
DepositionFeb 24, 1992-
Revision 1.0Apr 30, 1994Provider: repository / Type: Initial release
Revision 1.1Jun 14, 2011Group: Version format compliance
Revision 1.2Jul 13, 2011Group: Version format compliance
Revision 1.3Jul 27, 2011Group: Atomic model / Database references ...Atomic model / Database references / Derived calculations / Non-polymer description / Structure summary
Revision 1.4Dec 12, 2012Group: Other

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Assembly

Deposited unit
A: CYCLOSPORIN A


Theoretical massNumber of molelcules
Total (without water)1,2211
Polymers1,2211
Non-polymers00
Water0
1


  • Idetical with deposited unit
  • defined by author&software
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
MethodPQS
Atom site foot note1: RESIDUE ALA 8 IS A D-ALANINE.
NMR ensembles
DataCriteria
Number of conformers (submitted / calculated)18 / -
Representative

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Components

#1: Protein/peptide CYCLOSPORIN A / Ciclosporin / CYCLOSPORINE / CICLOSPORIN / CICLOSPORINE / Ciclosporin


Type: Cyclic peptide / Class: ImmunosuppressantImmunosuppressive drug / Mass: 1220.625 Da / Num. of mol.: 1 / Source method: obtained synthetically
Details: CYCLOSPORIN IS A CYCLIC UNDECAPEPTIDE. CYCLIZATION IS ACHIEVED BY LINKING THE N- AND THE C- TERMINI.
Source: (synth.) TOLYPOCLADIUM INFLATUM (fungus) / References: NOR: NOR00033, Cyclosporin A
Compound detailsCYCLOSPORIN IS A CYCLIC UNDECAPEPTIDE. HERE, CYCLOSPORIN A IS REPRESENTED BY THE SEQUENCE (SEQRES)

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Experimental details

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Experiment

ExperimentMethod: SOLUTION NMR

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Sample preparation

Crystal grow
*PLUS
Method: other / Details: NMR

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Processing

NMR softwareName: INSIGHT II / Developer: BIOSYM TECHNOLOGIES / Classification: refinement
NMR ensembleConformers submitted total number: 18

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