BMRB Entry 4392
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PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR4392
MolProbity Validation Chart
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NMR-STAR v3 text file.
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Citation: Yang, X.; Kaenzig, C.; Lee, M.; Wang, A.. "Binding of AR-1-144, a tri-imidazole DNA minor groove binder, to CCGG sequence
analyzed by NMR spectroscop" Eur. J. Biochem. 263, 646-655 (1999).
Assembly members:
DNA strand, polymer, 10 residues, Formula weight is not available
(2-{[4-({4-[(4-FORMYLAMINO-1-METHYL-1H-IMIDAZOLE-2-CARBONYL)-AMINO]-1-METHYL-1H-IMIDAZOLE-2-CARBONYL}-AMINO)-1-METHYL-1H-IMIDAZOLE-2-CARBONYL]-AMINO}-ETHYL)-DIMETHYL-AMMONIUM, non-polymer, 486.508 Da.
Natural source: Common Name: not available Taxonomy ID: not available Superkingdom: not available Kingdom: not available Genus/species: not available not available
Experimental source: Production method: chemically synthesized
Entity Sequences (FASTA):
DNA strand: GAACCGGTTC
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 104 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | DNA strand A | 1 |
| 2 | DNA strand B | 1 |
| 3 | AR-1-144 | 2 |
Entities:
Entity 1, DNA strand A 10 residues - Formula weight is not available
| 1 | DG | DA | DA | DC | DC | DG | DG | DT | DT | DC |
Entity 2, AR-1-144 - C20 H28 N11 O4 - 486.508 Da.
| 1 | AR1 |
Samples:
sample_1: DNA minor groove binder 1.25 mM
sample_conditions_set_1: pH: 7.0; temperature: 275 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| NOESY | sample_1 | not available | sample_conditions_set_1 |
| TOCSY | sample_1 | not available | sample_conditions_set_1 |
Software:
No software information available
NMR spectrometers:
- VARIAN Unity 750 MHz
- VARIAN VXR 500 MHz