BMRB Entry 5810
Chem Shift validation: AVS_anomalous, AVS_full
BMRB Entry DOI: doi:10.13018/BMR5810
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Title: 1H, 15N and 13C resonance assignment of staphostatin A, a specific Staphylococcus aureus cysteine proteinase inhibitor PubMed: 14621990
Deposition date: 2003-05-24 Original release date: 2003-12-18
Authors: Dubin, Grzegorz; Popowicz, Grzegorz; Krajewski, Marcin; Potempa, Jan; Dubin, Adam; Holak, Tad
Citation: Dubin, Grzegorz; Krajewski, Marcin; Popowicz, Grzegorz; Stec-Niemczyk, J.; Bochtler, M.; Potempa, Jan; Dubin, Adam; Holak, Tad. "A Novel Class of Cysteine Protease Inhibitors: Solution Structure of Staphostatin A from Staphylococcus aureus " Biochemistry 42, 13449-13456 (2003).
Assembly members:
Staphostatin A, polymer, 109 residues, Formula weight is not available
Natural source: Common Name: S. aureus Taxonomy ID: 1280 Superkingdom: Eubacteria Kingdom: not available Genus/species: Staphylococcus aureus
Experimental source: Production method: recombinant technology Host organism: Escherichia coli
Entity Sequences (FASTA):
Staphostatin A: GSMEQFELFSIDKFKCNSEA
KYYLNIIEGEWHPQDLNDSP
LKFILSTSDDSDYICKYINT
EHKQLTLYNKNNSSIVIEIF
IPNDNKILLTIMNTEALGTS
PRMTFIKHK
- assigned_chemical_shifts
- coupling_constants
| Data type | Count |
| 1H chemical shifts | 427 |
| 13C chemical shifts | 140 |
| 15N chemical shifts | 94 |
| coupling constants | 93 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | staphostatin A | 1 |
Entities:
Entity 1, staphostatin A 109 residues - Formula weight is not available
| 1 | GLY | SER | MET | GLU | GLN | PHE | GLU | LEU | PHE | SER | ||||
| 2 | ILE | ASP | LYS | PHE | LYS | CYS | ASN | SER | GLU | ALA | ||||
| 3 | LYS | TYR | TYR | LEU | ASN | ILE | ILE | GLU | GLY | GLU | ||||
| 4 | TRP | HIS | PRO | GLN | ASP | LEU | ASN | ASP | SER | PRO | ||||
| 5 | LEU | LYS | PHE | ILE | LEU | SER | THR | SER | ASP | ASP | ||||
| 6 | SER | ASP | TYR | ILE | CYS | LYS | TYR | ILE | ASN | THR | ||||
| 7 | GLU | HIS | LYS | GLN | LEU | THR | LEU | TYR | ASN | LYS | ||||
| 8 | ASN | ASN | SER | SER | ILE | VAL | ILE | GLU | ILE | PHE | ||||
| 9 | ILE | PRO | ASN | ASP | ASN | LYS | ILE | LEU | LEU | THR | ||||
| 10 | ILE | MET | ASN | THR | GLU | ALA | LEU | GLY | THR | SER | ||||
| 11 | PRO | ARG | MET | THR | PHE | ILE | LYS | HIS | LYS |
Samples:
sample1: Staphostatin A, [U-15N], 0.8 – 1.2 mM
sample2: Staphostatin A, [U-13C; U-15N], 0.7 mM
sample3: Staphostatin A0.8 – 1.3 mM
condition_1: pH: 7.4; temperature: 300 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| not available | not available | not available | condition_1 |
Software:
No software information available
NMR spectrometers:
- Bruker AMX 500 MHz
- Bruker DRX 600 MHz
- Bruker DMX 750 MHz
Related Database Links:
| PDB | |
| DBJ | BAB42996 BAB58072 BAB95716 BAF68120 BAF78778 |
| EMBL | CAG40987 CAG43638 CAI81535 CAQ50392 CCG16528 |
| GB | AAW36941 ABD31177 ABQ49750 ABR52833 ABX29913 |
| REF | NP_372434 NP_375017 NP_646668 WP_000434530 WP_000434531 |
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