BMRB Entry 18762
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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/BMR18762
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Title: NMR solution structure of an N2-guanine DNA adduct derived from the potent tumorigen dibenzo[a,l]pyrene: Intercalation from the minor groove with ruptured Watson-Crick base pairing PubMed: 23121427
Deposition date: 2012-10-04 Original release date: 2012-11-20
Authors: Tang, Yijin; Liu, Zhi; Ding, Shuang; Lin, Chin; Cai, Yuqin; Rodriguez, Fabian; Sayer, Jane; Jerina, Donald; Amin, Shantu; Broyde, Suse; Geacintov, Nicholas
Citation: Tang, Yijin; Liu, Zhi; Ding, Shuang; Lin, Chin; Cai, Yuqin; Rodriguez, Fabian; Sayer, Jane; Jerina, Donald; Amin, Shantu; Broyde, Suse; Geacintov, Nicholas. "Nuclear Magnetic Resonance Solution Structure of an N(2)-Guanine DNA Adduct Derived from the Potent Tumorigen Dibenzo[a,l]pyrene: Intercalation from the Minor Groove with Ruptured Watson-Crick Base Pairing." Biochemistry 51, 9751-9762 (2012).
Assembly members:
DNA_(5'-D(*CP*CP*AP*TP*CP*GP*CP*TP*AP*CP*C)-3')_, polymer, 11 residues, 3254.165 Da.
DNA_(5'-D(*GP*GP*TP*AP*GP*CP*GP*AP*TP*GP*G)-3')_, polymer, 11 residues, 3454.286 Da.
1,3-DIAMINOBENZYL PHENYLALANINE, non-polymer, 122.168 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: chemical synthesis
Entity Sequences (FASTA):
DNA_(5'-D(*CP*CP*AP*TP*CP*GP*CP*TP*AP*CP*C)-3')_: CCATCGCTACC
DNA_(5'-D(*GP*GP*TP*AP*GP*CP*GP*AP*TP*GP*G)-3')_: GGTAGCGATGG
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 154 |