DA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OP3 | P | sing | 1.61Å | 1.63Å | |
| OP3 | HOP3 | sing | 0.97Å | 0.95Å | |
| P | OP1 | doub | 1.48Å | 1.49Å | |
| P | OP2 | sing | 1.61Å | 1.44Å | |
| P | O5' | sing | 1.61Å | 1.58Å | |
| OP2 | HOP2 | sing | 0.97Å | 0.95Å | |
| O5' | C5' | sing | 1.43Å | 1.45Å | |
| C5' | C4' | sing | 1.53Å | 1.50Å | |
| C5' | H5' | sing | 1.09Å | 1.11Å | |
| C5' | H5'' | sing | 1.09Å | 1.11Å | |
| C4' | O4' | sing | 1.45Å | 1.44Å | |
| C4' | C3' | sing | 1.55Å | 1.53Å | |
| C4' | H4' | sing | 1.09Å | 1.11Å | |
| O4' | C1' | sing | 1.44Å | 1.44Å | |
| C3' | O3' | sing | 1.43Å | 1.45Å | |
| C3' | C2' | sing | 1.55Å | 1.52Å | |
| C3' | H3' | sing | 1.09Å | 1.11Å | |
| O3' | HO3' | sing | 0.97Å | 0.95Å | |
| C2' | C1' | sing | 1.54Å | 1.52Å | |
| C2' | H2' | sing | 1.09Å | 1.11Å | |
| C2' | H2'' | sing | 1.09Å | 1.12Å | |
| C1' | N9 | sing | 1.47Å | 1.45Å | |
| C1' | H1' | sing | 1.09Å | 1.12Å | |
| N9 | C8 | sing | 1.36Å | 1.37Å | Aromatic |
| N9 | C4 | sing | 1.37Å | 1.37Å | Aromatic |
| C8 | N7 | doub | 1.30Å | 1.29Å | Aromatic |
| C8 | H8 | sing | 1.08Å | 1.10Å | |
| N7 | C5 | sing | 1.35Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.40Å | 1.41Å | Aromatic |
| C5 | C4 | doub | 1.41Å | 1.39Å | Aromatic |
| C6 | N6 | sing | 1.38Å | 1.33Å | |
| C6 | N1 | doub | 1.33Å | 1.35Å | Aromatic |
| N6 | H61 | sing | 0.97Å | 1.02Å | |
| N6 | H62 | sing | 0.97Å | 1.02Å | |
| N1 | C2 | sing | 1.32Å | 1.34Å | Aromatic |
| C2 | N3 | doub | 1.32Å | 1.33Å | Aromatic |
| C2 | H2 | sing | 1.08Å | 1.10Å | |
| N3 | C4 | sing | 1.33Å | 1.34Å | Aromatic |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| P | OP3 | HOP3 | 106.6° | 106.8° |
| OP3 | P | OP1 | 106.6° | 109.5° |
| OP3 | P | OP2 | 107.2° | 109.4° |
| OP3 | P | O5' | 99.1° | 109.5° |
| OP1 | P | OP2 | 121.5° | 109.5° |
| OP1 | P | O5' | 110.7° | 109.5° |
| OP2 | P | O5' | 109.3° | 109.5° |
| P | OP2 | HOP2 | 121.4° | 106.8° |
| P | O5' | C5' | 118.9° | 106.8° |
| O5' | C5' | C4' | 107.6° | 109.5° |
| O5' | C5' | H5' | 112.9° | 109.4° |
| O5' | C5' | H5'' | 112.9° | 109.5° |
| C4' | C5' | H5' | 112.9° | 109.5° |
| C4' | C5' | H5'' | 112.8° | 109.5° |
| C5' | C4' | O4' | 110.9° | 110.8° |
| C5' | C4' | C3' | 115.8° | 110.6° |
| C5' | C4' | H4' | 102.7° | 110.5° |
| H5' | C5' | H5'' | 97.6° | 109.4° |
| O4' | C4' | C3' | 105.0° | 103.6° |
| O4' | C4' | H4' | 113.9° | 110.5° |
| C4' | O4' | C1' | 112.1° | 106.8° |
| C3' | C4' | H4' | 108.8° | 110.6° |
| C4' | C3' | O3' | 106.3° | 111.0° |
| C4' | C3' | C2' | 104.3° | 102.1° |
| C4' | C3' | H3' | 115.7° | 110.9° |
| O4' | C1' | C2' | 105.2° | 107.5° |
| O4' | C1' | N9 | 107.6° | 109.8° |
| O4' | C1' | H1' | 115.8° | 109.9° |
| O3' | C3' | C2' | 112.3° | 110.9° |
| O3' | C3' | H3' | 108.1° | 110.8° |
| C3' | O3' | HO3' | 106.3° | 106.9° |
| C2' | C3' | H3' | 110.1° | 111.0° |
| C3' | C2' | C1' | 103.6° | 104.2° |
| C3' | C2' | H2' | 114.5° | 110.5° |
| C3' | C2' | H2'' | 114.4° | 110.4° |
| C1' | C2' | H2' | 114.4° | 110.6° |
| C1' | C2' | H2'' | 114.4° | 110.5° |
| C2' | C1' | N9 | 115.7° | 109.9° |
| C2' | C1' | H1' | 107.7° | 109.9° |
| H2' | C2' | H2'' | 96.0° | 110.5° |
| N9 | C1' | H1' | 105.3° | 109.8° |
| C1' | N9 | C8 | 128.2° | 126.3° |
| C1' | N9 | C4 | 124.6° | 126.3° |
| C8 | N9 | C4 | 106.1° | 107.5° |
| N9 | C8 | N7 | 113.5° | 110.0° |
| N9 | C8 | H8 | 125.7° | 125.0° |
| N9 | C4 | C5 | 105.6° | 106.0° |
| N9 | C4 | N3 | 128.1° | 135.0° |
| N7 | C8 | H8 | 120.8° | 125.0° |
| C8 | N7 | C5 | 105.1° | 109.5° |
| N7 | C5 | C6 | 133.1° | 134.7° |
| N7 | C5 | C4 | 109.7° | 107.1° |
| C6 | C5 | C4 | 117.3° | 118.2° |
| C5 | C6 | N6 | 123.2° | 120.8° |
| C5 | C6 | N1 | 117.3° | 118.5° |
| C5 | C4 | N3 | 126.2° | 119.0° |
| N6 | C6 | N1 | 119.5° | 120.8° |
| C6 | N6 | H61 | 123.2° | 120.0° |
| C6 | N6 | H62 | 107.3° | 120.0° |
| C6 | N1 | C2 | 119.0° | 121.2° |
| H61 | N6 | H62 | 107.3° | 120.0° |
| N1 | C2 | N3 | 128.7° | 122.5° |
| N1 | C2 | H2 | 116.5° | 118.7° |
| N3 | C2 | H2 | 114.8° | 118.7° |
| C2 | N3 | C4 | 111.5° | 120.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OP3 | P | OP1 | OP2 | 123.0° | 119.9° |
| OP3 | P | OP1 | O5' | 106.8° | 120.0° |
| OP3 | P | OP2 | O5' | 106.5° | 120.0° |
| OP3 | P | OP2 | HOP2 | 57.3° | 60.1° |
| OP3 | P | O5' | C5' | 71.5° | 180.0° |
| HOP3 | OP3 | P | OP1 | 180.0° | 60.0° |
| HOP3 | OP3 | P | OP2 | 48.5° | 60.0° |
| HOP3 | OP3 | P | O5' | 65.0° | 180.0° |
| OP1 | P | OP2 | O5' | 130.8° | 120.0° |
| OP1 | P | OP2 | HOP2 | 180.0° | 180.0° |
| OP1 | P | O5' | C5' | 40.2° | 60.0° |
| OP2 | P | O5' | C5' | 176.6° | 60.1° |
| O5' | P | OP2 | HOP2 | 49.2° | 59.9° |
| P | O5' | C5' | C4' | 147.4° | 180.0° |
| P | O5' | C5' | H5' | 87.4° | 60.0° |
| P | O5' | C5' | H5'' | 22.2° | 60.0° |
| O5' | C5' | C4' | H5' | 125.3° | 120.0° |
| O5' | C5' | C4' | H5'' | 125.2° | 120.0° |
| O5' | C5' | H5' | H5'' | 118.9° | 120.0° |
| O5' | C5' | C4' | O4' | 69.6° | 65.7° |
| O5' | C5' | C4' | C3' | 50.0° | 180.0° |
| O5' | C5' | C4' | H4' | 168.4° | 57.1° |
| C4' | C5' | H5' | H5'' | 118.8° | 120.0° |
| C5' | C4' | O4' | C3' | 125.9° | 118.7° |
| C5' | C4' | O4' | H4' | 115.2° | 122.8° |
| C5' | C4' | C3' | H4' | 115.0° | 122.8° |
| C5' | C4' | O4' | C1' | 118.1° | 158.5° |
| C5' | C4' | C3' | O3' | 142.7° | 86.1° |
| C5' | C4' | C3' | C2' | 98.4° | 155.7° |
| C5' | C4' | C3' | H3' | 22.6° | 37.5° |
| H5' | C5' | C4' | O4' | 165.2° | 174.3° |
| H5' | C5' | C4' | C3' | 75.3° | 60.0° |
| H5' | C5' | C4' | H4' | 43.1° | 62.9° |
| H5'' | C5' | C4' | O4' | 55.7° | 54.3° |
| H5'' | C5' | C4' | C3' | 175.2° | 60.0° |
| H5'' | C5' | C4' | H4' | 66.4° | 177.1° |
| O4' | C4' | C3' | H4' | 122.3° | 118.4° |
| O4' | C4' | C3' | O3' | 94.6° | 155.2° |
| O4' | C4' | C3' | C2' | 24.3° | 37.0° |
| O4' | C4' | C3' | H3' | 145.4° | 81.3° |
| C4' | O4' | C1' | C2' | 12.1° | 26.3° |
| C4' | O4' | C1' | N9 | 136.0° | 145.8° |
| C4' | O4' | C1' | H1' | 106.6° | 93.2° |
| C3' | C4' | O4' | C1' | 7.7° | 39.9° |
| C4' | C3' | O3' | C2' | 113.5° | 112.7° |
| C4' | C3' | O3' | H3' | 124.9° | 123.6° |
| C4' | C3' | C2' | H3' | 124.7° | 118.2° |
| C4' | C3' | O3' | HO3' | 179.9° | 174.2° |
| C4' | C3' | C2' | C1' | 31.2° | 20.9° |
| C4' | C3' | C2' | H2' | 94.0° | 97.9° |
| C4' | C3' | C2' | H2'' | 156.5° | 139.5° |
| H4' | C4' | O4' | C1' | 126.6° | 78.6° |
| H4' | C4' | C3' | O3' | 27.7° | 36.7° |
| H4' | C4' | C3' | C2' | 146.6° | 81.4° |
| H4' | C4' | C3' | H3' | 92.4° | 160.3° |
| O4' | C1' | C2' | C3' | 26.8° | 1.9° |
| O4' | C1' | C2' | N9 | 118.6° | 119.5° |
| O4' | C1' | C2' | H1' | 124.0° | 119.6° |
| O4' | C1' | C2' | H2' | 98.5° | 120.7° |
| O4' | C1' | C2' | H2'' | 152.0° | 116.7° |
| O4' | C1' | N9 | H1' | 124.0° | 121.0° |
| O4' | C1' | N9 | C8 | 84.0° | 28.2° |
| O4' | C1' | N9 | C4 | 81.7° | 151.6° |
| O3' | C3' | C2' | H3' | 120.5° | 123.6° |
| O3' | C3' | C2' | C1' | 83.5° | 139.2° |
| O3' | C3' | C2' | H2' | 151.2° | 20.3° |
| O3' | C3' | C2' | H2'' | 41.8° | 102.2° |
| C2' | C3' | O3' | HO3' | 66.5° | 61.5° |
| C3' | C2' | C1' | H2' | 125.3° | 118.8° |
| C3' | C2' | C1' | H2'' | 125.2° | 118.6° |
| C3' | C2' | H2' | H2'' | 120.3° | 122.5° |
| C3' | C2' | C1' | N9 | 145.3° | 121.4° |
| C3' | C2' | C1' | H1' | 97.2° | 117.6° |
| H3' | C3' | O3' | HO3' | 55.2° | 62.2° |
| H3' | C3' | C2' | C1' | 156.0° | 97.3° |
| H3' | C3' | C2' | H2' | 30.7° | 143.9° |
| H3' | C3' | C2' | H2'' | 78.8° | 21.4° |
| C1' | C2' | H2' | H2'' | 120.3° | 122.6° |
| C2' | C1' | N9 | H1' | 118.7° | 121.0° |
| C2' | C1' | N9 | C8 | 33.2° | 89.8° |
| C2' | C1' | N9 | C4 | 161.0° | 90.3° |
| H2' | C2' | C1' | N9 | 20.0° | 119.8° |
| H2' | C2' | C1' | H1' | 137.5° | 1.2° |
| H2'' | C2' | C1' | N9 | 89.4° | 2.8° |
| H2'' | C2' | C1' | H1' | 28.0° | 123.8° |
| C1' | N9 | C8 | C4 | 167.8° | 179.9° |
| C1' | N9 | C8 | N7 | 168.4° | 179.9° |
| C1' | N9 | C8 | H8 | 11.6° | 0.1° |
| C1' | N9 | C4 | C5 | 168.0° | 179.8° |
| C1' | N9 | C4 | N3 | 12.3° | 0.1° |
| H1' | C1' | N9 | C8 | 152.0° | 149.3° |
| H1' | C1' | N9 | C4 | 42.3° | 30.6° |
| N9 | C8 | N7 | H8 | 180.0° | 180.0° |
| N9 | C8 | N7 | C5 | 1.3° | 0.3° |
| C8 | N9 | C4 | C5 | 0.4° | 0.3° |
| C8 | N9 | C4 | N3 | 179.3° | 180.0° |
| C4 | N9 | C8 | N7 | 0.6° | 0.0° |
| C4 | N9 | C8 | H8 | 179.5° | 180.0° |
| N9 | C4 | C5 | N7 | 1.3° | 0.5° |
| N9 | C4 | C5 | C6 | 178.9° | 179.7° |
| N9 | C4 | C5 | N3 | 179.8° | 179.7° |
| N9 | C4 | N3 | C2 | 179.9° | 180.0° |
| C8 | N7 | C5 | C6 | 178.6° | 179.5° |
| C8 | N7 | C5 | C4 | 1.6° | 0.4° |
| H8 | C8 | N7 | C5 | 178.7° | 179.7° |
| N7 | C5 | C6 | C4 | 179.8° | 179.0° |
| N7 | C5 | C6 | N6 | 2.2° | 0.7° |
| N7 | C5 | C6 | N1 | 178.1° | 179.5° |
| N7 | C5 | C4 | N3 | 178.5° | 179.8° |
| C5 | C6 | N6 | N1 | 179.7° | 179.7° |
| C5 | C6 | N6 | H61 | 180.0° | 179.7° |
| C5 | C6 | N6 | H62 | 54.8° | 0.5° |
| C5 | C6 | N1 | C2 | 1.0° | 0.3° |
| C6 | C5 | C4 | N3 | 1.4° | 0.6° |
| C4 | C5 | C6 | N6 | 178.0° | 179.7° |
| C4 | C5 | C6 | N1 | 1.7° | 0.6° |
| C5 | C4 | N3 | C2 | 0.2° | 0.3° |
| C6 | N6 | H61 | H62 | 125.2° | 179.8° |
| N6 | C6 | N1 | C2 | 178.7° | 180.0° |
| N1 | C6 | N6 | H61 | 0.3° | 0.0° |
| N1 | C6 | N6 | H62 | 125.5° | 179.8° |
| C6 | N1 | C2 | N3 | 0.4° | 0.0° |
| C6 | N1 | C2 | H2 | 179.6° | 179.9° |
| N1 | C2 | N3 | H2 | 180.0° | 180.0° |
| N1 | C2 | N3 | C4 | 0.8° | 0.0° |
| H2 | C2 | N3 | C4 | 179.2° | 179.9° |
