BMRB Entry 30355
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PDB ID: 6be7
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR30355
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Title: Solution structure of de novo macrocycle Design8.1 PubMed: 29242347
Deposition date: 2017-10-24 Original release date: 2018-01-02
Authors: Shortridge, M.; Hosseinzadeh, P.; Pardo-Avila, F.; Varani, G.; Baker, D.
Citation: Hosseinzadeh, P.; Bhardwaj, G.; Mulligan, V.; Shortridge, M.; Craven, T.; Pardo-Avila, F.; Rettie, S.; Kim, D.; Silva, D.; Ibrahim, Y.; Webb, I.; Cort, J.; Adkins, J.; Varani, G.; Baker, D.. "Comprehensive computational design of ordered peptide macrocycles." Science 358, 1461-1466 (2017).
Assembly members:
entity_1, polymer, 8 residues, 956.976 Da.
Natural source: Common Name: Human Taxonomy ID: 9606 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Homo sapiens
Experimental source: Production method: chemical synthesis
Entity Sequences (FASTA):
entity_1: DDPTXXQX
- assigned_chemical_shifts
| Data type | Count |
| 13C chemical shifts | 25 |
| 15N chemical shifts | 9 |
| 1H chemical shifts | 48 |
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