6AST
NMR and Restrained Molecular Dynamics Determination of the Structure of an Aza-Benzimidazole Derivative Complex with the DNA Minor Groove of an -AAGATA Sequence
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | DNA (5'-D(*CP*CP*AP*AP*GP*AP*TP*AP*G)-3') | polymer | 9 | 2748.8 | 1 | synthetic construct | ||
| 2 | B (B) | DNA (5'-D(*CP*TP*AP*TP*CP*TP*TP*GP*G)-3') | polymer | 9 | 2721.8 | 1 | synthetic construct | ||
| 3 | C (B) | amino(4-{[(2-{4-[amino(iminio)methyl]phenyl}-3H-imidazo[4,5-b]pyridin-5-yl)oxy]methyl}phenyl)methaniminium | non-polymer | 387.4 | 1 | Chemie (BVV) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 5470.6 | |
| Non-Polymers* | Number of molecules | 1 |
| Total formula weight | 387.4 | |
| All* | Total formula weight | 5858.1 |
