BMRB Entry 18037
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PDB ID: 4a52
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_anomalous, AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR18037
MolProbity Validation Chart
NMR-STAR file interactive viewer.
NMR-STAR v3 text file.
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Citation: Lecoq, Lauriane; Bougault, Catherine; Hugonnet, Jean-Emmanuel; Veckerle, Carole; Pessey, Ombeline; Arthur, Michel; Simorre, Jean-Pierre. "Dynamics Induced by beta-Lactam Antibiotics in the Active Site of Bacillus subtilisl,d-Transpeptidase." Structure 20, 850-861 (2012).
PubMed: 22579252
Assembly members:
ykud_imip, polymer, 175 residues, 18954.8503 Da.
Natural source: Common Name: BACILLUS SUBTILIS SUBSP. SUBTILIS STR. 168 Taxonomy ID: 224308 Superkingdom: not available Kingdom: Bacteria Genus/species: not available Bacillus
Experimental source: Production method: recombinant technology Host organism: Escherichia coli Vector: pET2818
- RDCs
- assigned_chemical_shifts
- heteronucl_NOEs
- heteronucl_T1_relaxation
- heteronucl_T2_relaxation
- spectral_peak_list
| Data type | Count |
| 13C chemical shifts | 643 |
| 15N chemical shifts | 164 |
| 1H chemical shifts | 1044 |
| T1 relaxation values | 116 |
| T2 relaxation values | 114 |
| heteronuclear NOE values | 117 |
| residual dipolar couplings | 191 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | ykud imip | 1 |
Entities:
Entity 1, ykud imip 175 residues - 18954.8503 Da.
| 1 | GLY | ARG | LYS | LEU | LEU | THR | TYR | GLN | VAL | LYS | ||||
| 2 | GLN | GLY | ASP | THR | LEU | ASN | SER | ILE | ALA | ALA | ||||
| 3 | ASP | PHE | ARG | ILE | SER | THR | ALA | ALA | LEU | LEU | ||||
| 4 | GLN | ALA | ASN | PRO | SER | LEU | GLN | ALA | GLY | LEU | ||||
| 5 | THR | ALA | GLY | GLN | SER | ILE | VAL | ILE | PRO | GLY | ||||
| 6 | LEU | PRO | ASP | PRO | TYR | THR | ILE | PRO | TYR | HIS | ||||
| 7 | ILE | ALA | VAL | SER | ILE | GLY | ALA | LYS | THR | LEU | ||||
| 8 | THR | LEU | SER | LEU | ASN | ASN | ARG | VAL | MET | LYS | ||||
| 9 | THR | TYR | PRO | ILE | ALA | VAL | GLY | LYS | ILE | LEU | ||||
| 10 | THR | GLN | THR | PRO | THR | GLY | GLU | PHE | TYR | ILE | ||||
| 11 | ILE | ASN | ARG | GLN | ARG | ASN | PRO | GLY | GLY | PRO | ||||
| 12 | PHE | GLY | ALA | TYR | TRP | LEU | SER | LEU | SER | LYS | ||||
| 13 | GLN | HIS | TYR | GLY | ILE | HIS | GLY | THR | ASN | ASN | ||||
| 14 | PRO | ALA | SER | ILE | GLY | LYS | ALA | VAL | SER | LYS | ||||
| 15 | GLY | CYS | ILE | ARG | MET | HIS | ASN | LYS | ASP | VAL | ||||
| 16 | ILE | GLU | LEU | ALA | SER | ILE | VAL | PRO | ASN | GLY | ||||
| 17 | THR | ARG | VAL | THR | ILE | ASN | ARG | GLY | SER | HIS | ||||
| 18 | HIS | HIS | HIS | HIS | HIS |
Related Database Links:
| UNP | YKUD_BACSU |
| BMRB | 17701 25192 |
| PDB | 1Y7M 2MTZ 3ZQD 4A1I 4A1J 4A1K 4A52 |
| DBJ | BAI85015 BAM52048 BAM57625 GAK78521 |
| EMBL | CAA10867 CAB13277 CCU57969 CEI56583 CEJ76989 |
| GB | ADV96423 AEP90550 AFQ57337 AGA22168 AGE63257 |
| REF | NP_389287 WP_009968919 WP_010886500 WP_014479657 WP_015252194 |
| SP | O34816 |
| AlphaFold | Q796K7 O34816 |
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