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Substance P 40 structures in water pH 5.5 298 K NMR DATA & STRUCTURES
Authors
Gayen, A., Mukhopadhyay, C.
Assembly
Substance P
Entity
1. Substance P (polymer, Thiol state: not present), 11 monomers, 1348.612 Da Detail

RPKPQQFFGL M


Formula weight
1348.612 Da
Source organism
Homo sapiens
Exptl. method
solution NMR
Refine. method
molecular dynamics, simulated annealing
Data set
assigned_chemical_shifts, conformer_family_coord_set
Chem. Shift Complete
Sequence coverage: 100.0 %, Completeness: 97.6 %, Completeness (bb): 95.2 % Detail

Polymer type: polypeptide(L)

Total1H
All97.6 % (82 of 84)97.6 % (82 of 84)
Backbone95.2 % (20 of 21)95.2 % (20 of 21)
Sidechain98.4 % (62 of 63)98.4 % (62 of 63)
Aromatic100.0 % (10 of 10)100.0 % (10 of 10)
Methyl100.0 % (2 of 2)100.0 % (2 of 2)

1. Substance P

RPKPQQFFGL M

Sample

Solvent system 90% H2O/10% D2O, Temperature 298 K, pH 5.5


#NameIsotope labelingTypeConcentration
1Substance Pnatural abundance3.7 mM

Protein Blocks Logo
Calculated from 5 models in PDB: 2KS9, Strand ID: B Detail


Release date
2010-10-26
Citation
NMR evidence of GM1-induced conformational change of Substance P using isotropic bicelles
Gayen, A., Goswami, S., Mukhopadhyay, C.
Biochim. Biophys. Acta (2011), 1808, 127-139, PubMed 20937248 , DOI 10.1016/j.bbamem.2010.09.023 ,
Entries sharing articles BMRB: 3, Swiss-Prot: 1 entries Detail
  BMRB: 16660 released on 2011-03-16
    Title SOLUTION CONFORMATION OF SUBSTANCE P IN WATER COMPLEXED WITH NK1R
  BMRB: 20116 released on 2010-10-26
    Title Substance P in DMPC:CHAPS q=0.25 bicelles
  BMRB: 20117 released on 2010-10-26
    Title Substance P 40 structures in water pH 5.5 298 K NMR DATA & STRUCTURES
  Swiss-Prot: P25103 released on 1992-05-01
    Title NK1R_HUMAN Entity Substance-P receptor
Related entities 1. Substance P, : 1 : 25 : 1 : 1 entities Detail
Interaction partners 1. Substance P, : 9 interactors Detail
Experiments performed 3 experiments Detail
nullKeywords NMR, Substance P, water, solution, peptide