BMRB Entry 5246
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR5246
NMR-STAR file interactive viewer.
NMR-STAR v3 text file.
NMR-STAR v2.1 text file (deprecated)
XML gzip file.
RDF gzip file.
All files associated with the entry
Title: Chiral Mutagenesis of Insulin's Hidden Receptor-Binding Surface: Structure of an Allo-isoleucine A2 Analogue PubMed: 11866509
Deposition date: 2001-12-27 Original release date: 2008-07-17
Authors: Xu, Bin; Hua, Qing-xin; Nakagawa, Satoe; Jia, Wenhua; Chu, Ying-Chi; Katsoyannis, Panayotis; Weiss, Michael
Citation: Xu, Bin; Hua, Qing-xin; Nakagawa, Satoe; Jia, Wenhua; Chu, Ying-Chi; Katsoyannis, Panayotis; Weiss, Michael. "Chiral Mutagenesis of Insulin's Hidden Receptor-binding Surface: Structure of an Allo-isoleucine(A2) Analogue " J. Mol. Biol. 316, 435-441 (2002).
Assembly members:
human insulin, polymer, 21 residues, Formula weight is not available
human insulin, polymer, 30 residues, Formula weight is not available
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):
human insulin: GXVEQCCTSICSLYQLENYC
N
human insulin: FVNQHLCGSDLVEALYLVCG
ERGFFYTKPT
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 475 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | allo-IleA2-DKP-insulin, chain A | 1 |
| 2 | allo-IleA2-DKP-insulin, chain B | 2 |
Entities:
Entity 1, allo-IleA2-DKP-insulin, chain A 21 residues - Formula weight is not available
| 1 | GLY | IIL | VAL | GLU | GLN | CYS | CYS | THR | SER | ILE | ||||
| 2 | CYS | SER | LEU | TYR | GLN | LEU | GLU | ASN | TYR | CYS | ||||
| 3 | ASN |
Entity 2, allo-IleA2-DKP-insulin, chain B 30 residues - Formula weight is not available
| 1 | PHE | VAL | ASN | GLN | HIS | LEU | CYS | GLY | SER | ASP | |
| 2 | LEU | VAL | GLU | ALA | LEU | TYR | LEU | VAL | CYS | GLY | |
| 3 | GLU | ARG | GLY | PHE | PHE | TYR | THR | LYS | PRO | THR |
Samples:
sample_1: human insulin 1.2 mM; human insulin 1.2 mM
cond_1: pH: 7.0; temperature: 298 K
cond_2: pD: 7.6; temperature: 305 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D 1H-1H NOESY | sample_1 | not available | not available |
| 2D 1H-1H TOCSY | sample_1 | not available | not available |
| 2D 1H-1H DQF-COSY | sample_1 | not available | not available |
Software:
VNMR v6.1B - NMR data processing
NMR spectrometers:
- Varian INOVA 600 MHz