7UBI

Solution NMR structure of 8-residue Rosetta-designed cyclic peptide D8.21 in CDCl3 with cis/trans switching (TT conformation, 47%)

Summary for 7UBI

• Entry DOI: 10.2210/pdb7ubi/pdb
• Related: 8CWA
• NMR Information: BMRB: 31003
• Descriptor: Cyclic peptide D8.21 DVA-MLE-DPR-LEU-DVA-MLE-DPR-LEU (1 entity in total)
• Functional Keywords: cyclic peptide, non natural amino acids, cis/trans, switch peptides, de novo design, membrane permeability, de novo protein
• Biological source: synthetic construct
• Total number of polymer chains: 1
• Total formula weight: 891.19

Authors

Ramelot, T.A.,Tejero, R.,Montelione, G.T. (deposition date: 2022-03-14, release date: 2022-09-14, Last modification date: 2022-09-28)

• Primary citation: Bhardwaj, G.,O'Connor, J.,Rettie, S.,Huang, Y.H.,Ramelot, T.A.,Mulligan, V.K.,Alpkilic, G.G.,Palmer, J.,Bera, A.K.,Bick, M.J.,Di Piazza, M.,Li, X.,Hosseinzadeh, P.,Craven, T.W.,Tejero, R.,Lauko, A.,Choi, R.,Glynn, C.,Dong, L.,Griffin, R.,van Voorhis, W.C.,Rodriguez, J.,Stewart, L.,Montelione, G.T.,Craik, D.,Baker, D.; Accurate de novo design of membrane-traversing macrocycles.; Cell, 185:3520-3532.e26, 2022; PubMed: 36041435; DOI: 10.1016/j.cell.2022.07.019

Experimental method

SOLUTION NMR