BMRB Entry 18942
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PDB ID: 2m32
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_anomalous, AVS_full, LACS, SPARTA
BMRB Entry DOI: doi:10.13018/BMR18942
MolProbity Validation Chart
NMR-STAR file interactive viewer.
NMR-STAR v3 text file.
XML gzip file.
RDF gzip file.
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Citation: Chin, Yanni K-Y; Headey, Stephen; Mohanty, Biswaranjan; Patil, Rahul; McEwan, Paul; Swarbrick, James; Mulhern, Terrence; Emsley, Jonas; Simpson, Jamie; Scanlon, Martin. "The structure of integrin 1I domain in complex with a collagen-mimetic peptide." J. Biol. Chem. 288, 36796-36809 (2013).
PubMed: 24187131
Assembly members:
entity_1, polymer, 192 residues, 21513.508 Da.
entity_2, polymer, 23 residues, 1936.040 Da.
entity_MG, non-polymer, 24.305 Da.
Natural source: Common Name: Human Taxonomy ID: 9606 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Homo sapiens
Experimental source: Production method: recombinant technology Host organism: Escherichia coli Vector: pET28a+
- assigned_chemical_shifts
| Data type | Count |
| 13C chemical shifts | 740 |
| 15N chemical shifts | 189 |
| 1H chemical shifts | 1214 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | alpha-1 integrin I-domain | 1 |
| 2 | GLOGEN triple helical peptide, 1 | 2 |
| 3 | GLOGEN triple helical peptide, 2 | 2 |
| 4 | GLOGEN triple helical peptide, 3 | 2 |
| 5 | MG2 | 3 |
Entities:
Entity 1, alpha-1 integrin I-domain 192 residues - 21513.508 Da.
| 1 | SER | THR | GLN | LEU | ASP | ILE | VAL | ILE | VAL | LEU | ||||
| 2 | ASP | GLY | SER | ASN | SER | ILE | TYR | PRO | TRP | ASP | ||||
| 3 | SER | VAL | THR | ALA | PHE | LEU | ASN | ASP | LEU | LEU | ||||
| 4 | GLU | ARG | MET | ASP | ILE | GLY | PRO | LYS | GLN | THR | ||||
| 5 | GLN | VAL | GLY | ILE | VAL | GLN | TYR | GLY | GLU | ASN | ||||
| 6 | VAL | THR | HIS | GLU | PHE | ASN | LEU | ASN | LYS | TYR | ||||
| 7 | SER | SER | THR | GLU | GLU | VAL | LEU | VAL | ALA | ALA | ||||
| 8 | LYS | LYS | ILE | VAL | GLN | ARG | GLY | GLY | ARG | GLN | ||||
| 9 | THR | MET | THR | ALA | LEU | GLY | ILE | ASP | THR | ALA | ||||
| 10 | ARG | LYS | GLU | ALA | PHE | THR | GLU | ALA | ARG | GLY | ||||
| 11 | ALA | ARG | ARG | GLY | VAL | LYS | LYS | VAL | MET | VAL | ||||
| 12 | ILE | VAL | THR | ASP | GLY | GLU | SER | HIS | ASP | ASN | ||||
| 13 | HIS | ARG | LEU | LYS | LYS | VAL | ILE | GLN | ASP | CYS | ||||
| 14 | GLU | ASP | GLU | ASN | ILE | GLN | ARG | PHE | SER | ILE | ||||
| 15 | ALA | ILE | LEU | GLY | SER | TYR | ASN | ARG | GLY | ASN | ||||
| 16 | LEU | SER | THR | GLU | LYS | PHE | VAL | GLU | GLU | ILE | ||||
| 17 | LYS | SER | ILE | ALA | SER | GLU | PRO | THR | GLU | LYS | ||||
| 18 | HIS | PHE | PHE | ASN | VAL | SER | ASP | GLU | LEU | ALA | ||||
| 19 | LEU | VAL | THR | ILE | VAL | LYS | THR | LEU | GLY | GLU | ||||
| 20 | ARG | ILE |
Entity 2, GLOGEN triple helical peptide, 1 23 residues - 1936.040 Da.
| 1 | ACE | GLY | PRO | HYP | GLY | PRO | HYP | GLY | LEU | HYP | ||||
| 2 | GLY | GLU | ASN | GLY | PRO | HYP | GLY | PRO | HYP | GLY | ||||
| 3 | PRO | HYP | NH2 |
Entity 3, MG2 - Mg - 24.305 Da.
| 1 | MG |
Related Database Links:
| BMRB | 18020 18021 |
| PDB | 1PT6 1QC5 1QCY 2M32 4A0Q |
| DBJ | BAG62150 |
| GB | AAI37122 AAI37123 EAW54866 EAW54867 EAW54868 |
| REF | NP_852478 XP_001094788 XP_002815595 XP_003276564 XP_003827398 |
| SP | P56199 |
| AlphaFold | P56199 |
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