Biological Magnetic Resonance Data Bank

A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

BMRB Entry 27800

Title: 1H and 13C assignment of cyclosporin C in CDCl3

Deposition date: 2019-02-25 Original release date: 2019-03-01

Authors: Efimov, Sergey; Darwish, Shaza; Klochkov, Vladimir

Citation: Efimov, Sergey; Darwish, Shaza; Zgadzay, Yuriy; Klochkov, Vladimir. "Comparison of four cyclosporin variants A, B, C and D based on NMR spectroscopy"  .

Assembly members:
CsC, polymer, 11 residues, 1218.6 Da.

Natural source:   Common Name: Tolypocladium inflatum   Taxonomy ID: 29910   Superkingdom: Eukaryota   Kingdom: Fungi   Genus/species: Tolypocladium inflatum

Experimental source:   Production method: chemical synthesis   Host organism: Tolypocladium inflatum

Entity Sequences (FASTA):

Data sets:
Data typeCount
13C chemical shifts62
1H chemical shifts110
coupling constants34

Additional metadata:

  • Assembly
  • Samples and Experiments
  • Software
  • Spectrometers
  • Hide all


Entity Assembly IDEntity NameEntity ID


Entity 1, CsC 11 residues - 1218.6 Da.

Residues 1(Bmt), 3(G), 4, 6, 9, 10, 11 are N-methylated. Residue 8 is d-Ala.

2   MVA


sample_1: CsC 1.38 mM

sample_conditions_1: pressure: 1 atm; temperature: 298.2 K


NameSampleSample stateSample conditions
2D DQF-COSYsample_1isotropicsample_conditions_1
2D 1H-1H TOCSYsample_1isotropicsample_conditions_1
2D 1H-13C HSQCsample_1isotropicsample_conditions_1
2D 1H-1H NOESYsample_1isotropicsample_conditions_1
2D 1H-13C HMBCsample_1isotropicsample_conditions_1
1D 1Hsample_1isotropicsample_conditions_1


TOPSPIN v3.2, Bruker Biospin - collection

NMRPipe, Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax - processing

SPARKY v3.114, Goddard - chemical shift assignment

NMR spectrometers:

  • Bruker Avance 700 MHz