BMRB Entry 6430
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR6430
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Title: 1H and 31P chemical shift assignments for HIV-1 integrase inhibitor 93del
Deposition date: 2004-12-13 Original release date: 2009-07-06
Authors: Phan, Anh Tuan; Kuryavyi, Vitaly; Ma, Jin-Biao; Faure, Aurelie; Andreola, Marie-Line; Patel, Dinshaw
Citation: Phan, Anh Tuan; Kuryavyi, Vitaly; Ma, Jin-Biao; Faure, Aurelie; Andreola, Marie-Line; Patel, Dinshaw. "An interlocked dimeric parallel-stranded DNA quadruplex: a potent inhibitor of HIV-1 integrase" Proc. Natl. Acad. Sci. U.S.A. 102, 634-639 (2005).
Assembly members:
HIV-1 integrase inhibitor, polymer, 16 residues, Formula weight is not available
Natural source: Common Name: not available Taxonomy ID: not available Superkingdom: unclassified Kingdom: not available Genus/species: not available not available
Experimental source: Production method: chemical synthesis
Entity Sequences (FASTA):
HIV-1 integrase inhibitor: GGGGTGGGAGGAGGGT
- assigned_chemical_shifts
Data type | Count |
1H chemical shifts | 148 |
31P chemical shifts | 15 |
Additional metadata:
Assembly:
Entity Assembly ID | Entity Name | Entity ID |
---|---|---|
1 | 93del subunit 1 | 1 |
2 | 93del subunit 2 | 1 |
Entities:
Entity 1, 93del subunit 1 16 residues - Formula weight is not available
1 | DG | DG | DG | DG | DT | DG | DG | DG | DA | DG | ||||
2 | DG | DA | DG | DG | DG | DT |
Samples:
sample_1: HIV-1 integrase inhibitor 2.0 mM; K+ 0.09 M
sample_2: HIV-1 integrase inhibitor 9.0 mM; K+ 0.09 M
condition_1: ionic strength: 90 mM; pH: 7.0; temperature: 298 K
Experiments:
Name | Sample | Sample state | Sample conditions |
---|---|---|---|
1H-15N JRHMQC | not available | not available | condition_1 |
1H-15N HMBC | not available | not available | condition_1 |
1H-13C JRHMBC | not available | not available | condition_1 |
1H-13C HMBC | not available | not available | condition_1 |
1H-13C HSQC | not available | not available | condition_1 |
1H-13C sHMBC | not available | not available | condition_1 |
1H-31P TOCSY | not available | not available | condition_1 |
1H-31P HSQC | not available | not available | condition_1 |
1H-1H COSY | not available | not available | condition_1 |
1H-1H TOCSY | not available | not available | condition_1 |
1H-1H JRNOESY | not available | not available | condition_1 |
1H-1H NOESY | not available | not available | condition_1 |
Software:
FELIX -
NMR spectrometers:
- Varian Unity INOVA 500 MHz
- Varian Unity INOVA 600 MHz
- Bruker AVANCE 600 MHz