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
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Title: NMR STRUCTURE OF THE IMIPENEM-ACYLATED L,D-TRANSPEPTIDASE FROM BACILLUS SUBTILIS PubMed: 22579252
Deposition date: 2011-11-01 Original release date: 2012-05-22
Authors: Lecoq, Lauriane; Simorre, Jean-Pierre; Bougault, Catherine; Arthur, Michel; Hugonnet, Jean-Emmanuel; Veckerle, Carole; Pessey, Ombeline
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).
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
Entity Sequences (FASTA):
ykud_imip: GRKLLTYQVKQGDTLNSIAA
DFRISTAALLQANPSLQAGL
TAGQSIVIPGLPDPYTIPYH
IAVSIGAKTLTLSLNNRVMK
TYPIAVGKILTQTPTGEFYI
INRQRNPGGPFGAYWLSLSK
QHYGIHGTNNPASIGKAVSK
GCIRMHNKDVIELASIVPNG
TRVTINRGSHHHHHH
- assigned_chemical_shifts
- 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:
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 |
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