BMRB Entry 4892
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PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_anomalous, AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR4892
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: Rustandi, Richard; Vallely, Kristen; Varlamova, Olga; Klein, Michael; Almo, Steven; Bresnick, Anne; Weber, David. "Letter to the Editor:
1H, 13C and 15N NMR sequence-specific resonance
assignments for human apo-Mts1 (S100A4)" J. Biomol. NMR 19, 381-382 (2001).
Assembly members:
S100A4, polymer, 101 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: recombinant technology
Entity Sequences (FASTA):
S100A4: MACPLEKALDVMVSTFHKYS
GKEGDKFKLNKSELKELLTR
ELPSFLGKRTDEAAFQKLMS
NLDSNRDNEVDFQEYCVFLS
CIAMMCNEFFEGFPDKQPRK
K
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 425 |
| 13C chemical shifts | 244 |
| 15N chemical shifts | 85 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | S100A4 subunit 1 | 1 |
| 2 | S100A4 subunit 2 | 1 |
Entities:
Entity 1, S100A4 subunit 1 101 residues - Formula weight is not available
| 1 | MET | ALA | CYS | PRO | LEU | GLU | LYS | ALA | LEU | ASP | ||||
| 2 | VAL | MET | VAL | SER | THR | PHE | HIS | LYS | TYR | SER | ||||
| 3 | GLY | LYS | GLU | GLY | ASP | LYS | PHE | LYS | LEU | ASN | ||||
| 4 | LYS | SER | GLU | LEU | LYS | GLU | LEU | LEU | THR | ARG | ||||
| 5 | GLU | LEU | PRO | SER | PHE | LEU | GLY | LYS | ARG | THR | ||||
| 6 | ASP | GLU | ALA | ALA | PHE | GLN | LYS | LEU | MET | SER | ||||
| 7 | ASN | LEU | ASP | SER | ASN | ARG | ASP | ASN | GLU | VAL | ||||
| 8 | ASP | PHE | GLN | GLU | TYR | CYS | VAL | PHE | LEU | SER | ||||
| 9 | CYS | ILE | ALA | MET | MET | CYS | ASN | GLU | PHE | PHE | ||||
| 10 | GLU | GLY | PHE | PRO | ASP | LYS | GLN | PRO | ARG | LYS | ||||
| 11 | LYS |
Samples:
sample_1: S100A4, [U-13C; U-15N], 3 mM
S100A4-cond_1: pH: 6.5; temperature: 310 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D 1H,15N-HSQC | not available | not available | not available |
| 3D 15N-edited NOESY-HSQC | not available | not available | not available |
| 3D 15N-edited HOHAHA-HSQC | not available | not available | not available |
| 3D 15N,15N-edited HMQC-NOESY-HSQC | not available | not available | not available |
| 3D 15N HNHA | not available | not available | not available |
| 3D CCONH | not available | not available | not available |
| 3D CBCA(CO)NH | not available | not available | not available |
| 3D HNCACB | not available | not available | not available |
| 4D 13C,15N-edited NOESY-HSQC | not available | not available | not available |
| 4D 13C,13C-edited NOESY-HSQC | not available | not available | not available |
Software:
nmrPipe -
NMR spectrometers:
- Bruker DMX 600 MHz
Related Database Links:
| BMRB | 18169 |
| PDB | |
| DBJ | BAF84772 BAG74210 |
| EMBL | CAA79474 CAA83880 CAG29341 |
| GB | AAA51920 AAH00838 AAH16300 AAV74399 AAX29777 |
| REF | NP_001239534 NP_002952 NP_062427 XP_001110635 XP_001110673 |
| SP | P26447 |
| AlphaFold | P26447 |
Download HSQC peak lists in one of the following formats:
CSV: Backbone
or all simulated peaks
SPARKY: Backbone
or all simulated peaks