BMRB Entry 6101
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PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR6101
MolProbity Validation Chart
NMR-STAR file interactive viewer.
NMR-STAR v3 text file.
XML gzip file.
RDF gzip file.
All files associated with the entry
Citation: Navarro, E.; Fennude, E.; Celda, B.. "Solution Structure of a D,L-Alternating Oligonorleucine as a Model of Double-Stranded Antiparallel beta-helix" Biopolymers 64, 198-209 (2002).
PubMed: 12115137
Assembly members:
METHYL ESTER, polymer, 15 residues, Formula weight is not available
Natural source: Common Name: not available Taxonomy ID: not available Superkingdom: not available Kingdom: not available Genus/species: not available not available
Experimental source: Production method: chemical synthesis
Entity Sequences (FASTA):
METHYL ESTER: XXXXXXXXXXXXXXX
- assigned_chemical_shifts
| Data type | Count |
| 13C chemical shifts | 15 |
| 1H chemical shifts | 86 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | METHYL ESTER chain A | 1 |
| 2 | METHYL ESTER chain B | 1 |
Entities:
Entity 1, METHYL ESTER chain A 15 residues - Formula weight is not available
| 1 | NLE | DNE | NLE | DNE | NLE | DNE | NLE | DNE | NLE | DNE | ||||
| 2 | NLE | DNM | NLE | DNE | NLE |
Samples:
sample_1: METHYL_ESTER 4.7 mM
sample_cond_1: pressure: 1 atm; temperature: 303 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D ROESY | sample_1 | not available | sample_cond_1 |
| 2D TOCSY | sample_1 | not available | sample_cond_1 |
| DQF-COSY | sample_1 | not available | sample_cond_1 |
Software:
DISCOVER v2.9.7 - refinement, structure solution
VNMR - data analysis
NMR spectrometers:
- Varian UNITY 400 MHz