147
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| C1 | O5 | sing | 1.43Å | 1.41Å | |
| C1 | O1 | sing | 1.43Å | 1.42Å | |
| C1 | H1 | sing | 1.09Å | 1.12Å | |
| C2 | O2 | sing | 1.43Å | 1.43Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C2 | H2 | sing | 1.09Å | 1.12Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å | |
| C3 | O3 | sing | 1.43Å | 1.44Å | |
| C3 | C4 | sing | 1.53Å | 1.51Å | |
| C3 | H3 | sing | 1.09Å | 1.12Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C4 | O4 | sing | 1.43Å | 1.43Å | |
| C4 | C5 | sing | 1.53Å | 1.55Å | |
| C4 | H4 | sing | 1.09Å | 1.12Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| C5 | C6 | sing | 1.53Å | 1.51Å | |
| C5 | O5 | sing | 1.43Å | 1.44Å | |
| C5 | H5 | sing | 1.09Å | 1.12Å | |
| C6 | O6 | sing | 1.43Å | 1.46Å | |
| C6 | H61 | sing | 1.09Å | 1.12Å | |
| C6 | H62 | sing | 1.09Å | 1.11Å | |
| O6 | HO6 | sing | 0.97Å | 0.95Å | |
| O1 | C1' | sing | 1.36Å | 1.38Å | |
| C1' | C2' | doub | 1.39Å | 1.41Å | Aromatic |
| C1' | C6' | sing | 1.39Å | 1.41Å | Aromatic |
| C2' | C3' | sing | 1.38Å | 1.39Å | Aromatic |
| C2' | H2' | sing | 1.08Å | 1.10Å | |
| C3' | C4' | doub | 1.38Å | 1.35Å | Aromatic |
| C3' | H3' | sing | 1.08Å | 1.10Å | |
| C4' | C5' | sing | 1.38Å | 1.39Å | Aromatic |
| C4' | N1' | sing | 1.48Å | 1.43Å | |
| C5' | C6' | doub | 1.38Å | 1.38Å | Aromatic |
| C5' | H5' | sing | 1.08Å | 1.10Å | |
| C6' | H6' | sing | 1.08Å | 1.10Å | |
| N1' | O2' | sing | 1.22Å | 1.19Å | |
| N1' | O3' | doub | 1.22Å | 1.22Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | O5 | 108.7° | 109.8° |
| C2 | C1 | O1 | 105.7° | 109.4° |
| C2 | C1 | H1 | 110.6° | 109.4° |
| C1 | C2 | O2 | 109.0° | 109.6° |
| C1 | C2 | C3 | 115.1° | 109.1° |
| C1 | C2 | H2 | 106.8° | 109.6° |
| O5 | C1 | O1 | 103.7° | 109.4° |
| O5 | C1 | H1 | 112.5° | 109.4° |
| C1 | O5 | C5 | 111.9° | 107.6° |
| O1 | C1 | H1 | 115.1° | 109.4° |
| C1 | O1 | C1' | 115.9° | 106.8° |
| O2 | C2 | C3 | 111.8° | 109.6° |
| O2 | C2 | H2 | 110.4° | 109.5° |
| C2 | O2 | HO2 | 109.0° | 106.7° |
| C3 | C2 | H2 | 103.6° | 109.5° |
| C2 | C3 | O3 | 106.0° | 109.6° |
| C2 | C3 | C4 | 112.6° | 108.6° |
| C2 | C3 | H3 | 108.9° | 109.6° |
| O3 | C3 | C4 | 106.7° | 109.7° |
| O3 | C3 | H3 | 114.6° | 109.6° |
| C3 | O3 | HO3 | 106.0° | 106.8° |
| C4 | C3 | H3 | 108.2° | 109.7° |
| C3 | C4 | O4 | 109.8° | 109.6° |
| C3 | C4 | C5 | 105.5° | 109.0° |
| C3 | C4 | H4 | 111.2° | 109.6° |
| O4 | C4 | C5 | 107.6° | 109.7° |
| O4 | C4 | H4 | 109.3° | 109.6° |
| C4 | O4 | HO4 | 109.8° | 106.7° |
| C5 | C4 | H4 | 113.3° | 109.4° |
| C4 | C5 | C6 | 115.2° | 109.4° |
| C4 | C5 | O5 | 111.3° | 109.8° |
| C4 | C5 | H5 | 102.9° | 109.4° |
| C6 | C5 | O5 | 105.7° | 109.4° |
| C6 | C5 | H5 | 108.9° | 109.4° |
| C5 | C6 | O6 | 113.6° | 109.5° |
| C5 | C6 | H61 | 110.6° | 109.5° |
| C5 | C6 | H62 | 110.7° | 109.4° |
| O5 | C5 | H5 | 112.9° | 109.4° |
| O6 | C6 | H61 | 110.7° | 109.5° |
| O6 | C6 | H62 | 110.7° | 109.5° |
| C6 | O6 | HO6 | 113.6° | 106.8° |
| H61 | C6 | H62 | 99.7° | 109.4° |
| O1 | C1' | C2' | 114.7° | 120.0° |
| O1 | C1' | C6' | 125.3° | 120.1° |
| C2' | C1' | C6' | 120.1° | 119.9° |
| C1' | C2' | C3' | 120.2° | 119.9° |
| C1' | C2' | H2' | 120.7° | 120.0° |
| C1' | C6' | C5' | 119.6° | 119.9° |
| C1' | C6' | H6' | 121.1° | 120.0° |
| C3' | C2' | H2' | 119.1° | 120.1° |
| C2' | C3' | C4' | 117.6° | 120.1° |
| C2' | C3' | H3' | 122.3° | 120.0° |
| C4' | C3' | H3' | 120.1° | 119.9° |
| C3' | C4' | C5' | 124.8° | 120.1° |
| C3' | C4' | N1' | 115.9° | 120.0° |
| C5' | C4' | N1' | 119.0° | 119.9° |
| C4' | C5' | C6' | 117.7° | 120.1° |
| C4' | C5' | H5' | 121.7° | 119.9° |
| C4' | N1' | O2' | 119.4° | 119.9° |
| C4' | N1' | O3' | 117.8° | 120.0° |
| C6' | C5' | H5' | 120.6° | 120.0° |
| C5' | C6' | H6' | 119.3° | 120.1° |
| O2' | N1' | O3' | 122.8° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | O5 | O1 | 112.1° | 120.1° |
| C2 | C1 | O5 | H1 | 122.8° | 120.1° |
| C2 | C1 | O1 | H1 | 122.4° | 119.9° |
| C1 | C2 | O2 | C3 | 128.4° | 119.6° |
| C1 | C2 | O2 | H2 | 116.9° | 120.2° |
| C1 | C2 | C3 | H2 | 116.1° | 119.9° |
| C1 | C2 | O2 | HO2 | 180.0° | 60.0° |
| C1 | C2 | C3 | O3 | 163.2° | 173.6° |
| C1 | C2 | C3 | C4 | 46.9° | 53.8° |
| C1 | C2 | C3 | H3 | 73.1° | 66.0° |
| C2 | C1 | O5 | C5 | 59.1° | 67.6° |
| C2 | C1 | O1 | C1' | 159.8° | 174.7° |
| O5 | C1 | O1 | H1 | 123.3° | 119.8° |
| O5 | C1 | C2 | O2 | 175.2° | 178.8° |
| O5 | C1 | C2 | C3 | 48.7° | 61.2° |
| O5 | C1 | C2 | H2 | 65.6° | 58.6° |
| C1 | O5 | C5 | C4 | 69.0° | 67.6° |
| C1 | O5 | C5 | C6 | 165.2° | 172.3° |
| C1 | O5 | C5 | H5 | 46.2° | 52.4° |
| O5 | C1 | O1 | C1' | 85.9° | 65.0° |
| O1 | C1 | C2 | O2 | 74.0° | 58.7° |
| O1 | C1 | C2 | C3 | 159.5° | 178.7° |
| O1 | C1 | C2 | H2 | 45.2° | 61.4° |
| O1 | C1 | O5 | C5 | 171.2° | 172.4° |
| C1 | O1 | C1' | C2' | 172.8° | 180.0° |
| C1 | O1 | C1' | C6' | 7.9° | 0.3° |
| H1 | C1 | C2 | O2 | 51.2° | 61.2° |
| H1 | C1 | C2 | C3 | 75.3° | 58.8° |
| H1 | C1 | C2 | H2 | 170.4° | 178.7° |
| H1 | C1 | O5 | C5 | 63.7° | 52.5° |
| H1 | C1 | O1 | C1' | 37.4° | 54.8° |
| O2 | C2 | C3 | H2 | 118.8° | 120.2° |
| O2 | C2 | C3 | O3 | 71.7° | 66.4° |
| O2 | C2 | C3 | C4 | 172.0° | 173.7° |
| O2 | C2 | C3 | H3 | 52.0° | 53.9° |
| C3 | C2 | O2 | HO2 | 51.6° | 179.6° |
| C2 | C3 | O3 | C4 | 120.2° | 119.2° |
| C2 | C3 | O3 | H3 | 120.1° | 120.3° |
| C2 | C3 | C4 | H3 | 120.4° | 119.8° |
| C2 | C3 | O3 | HO3 | 179.9° | 60.0° |
| C2 | C3 | C4 | O4 | 66.1° | 66.2° |
| C2 | C3 | C4 | C5 | 49.6° | 53.8° |
| C2 | C3 | C4 | H4 | 172.8° | 173.5° |
| H2 | C2 | O2 | HO2 | 63.1° | 60.2° |
| H2 | C2 | C3 | O3 | 47.1° | 53.7° |
| H2 | C2 | C3 | C4 | 69.2° | 66.1° |
| H2 | C2 | C3 | H3 | 170.8° | 174.1° |
| O3 | C3 | C4 | H3 | 123.7° | 120.4° |
| O3 | C3 | C4 | O4 | 49.7° | 53.6° |
| O3 | C3 | C4 | C5 | 165.4° | 173.6° |
| O3 | C3 | C4 | H4 | 71.3° | 66.6° |
| C4 | C3 | O3 | HO3 | 59.8° | 179.2° |
| C3 | C4 | O4 | C5 | 114.3° | 119.6° |
| C3 | C4 | O4 | H4 | 122.2° | 120.3° |
| C3 | C4 | C5 | H4 | 121.9° | 119.9° |
| C3 | C4 | O4 | HO4 | 180.0° | 60.1° |
| C3 | C4 | C5 | C6 | 178.8° | 178.6° |
| C3 | C4 | C5 | O5 | 60.9° | 61.3° |
| C3 | C4 | C5 | H5 | 60.4° | 58.7° |
| H3 | C3 | O3 | HO3 | 59.9° | 60.3° |
| H3 | C3 | C4 | O4 | 173.5° | 174.0° |
| H3 | C3 | C4 | C5 | 70.8° | 66.0° |
| H3 | C3 | C4 | H4 | 52.4° | 53.7° |
| O4 | C4 | C5 | H4 | 120.9° | 120.2° |
| O4 | C4 | C5 | C6 | 64.1° | 61.5° |
| O4 | C4 | C5 | O5 | 56.3° | 58.6° |
| O4 | C4 | C5 | H5 | 177.6° | 178.7° |
| C5 | C4 | O4 | HO4 | 65.7° | 179.6° |
| C4 | C5 | C6 | O5 | 123.4° | 120.3° |
| C4 | C5 | C6 | H5 | 115.0° | 119.9° |
| C4 | C5 | O5 | H5 | 115.2° | 120.1° |
| C4 | C5 | C6 | O6 | 52.3° | 174.8° |
| C4 | C5 | C6 | H61 | 72.9° | 65.1° |
| C4 | C5 | C6 | H62 | 177.6° | 54.8° |
| H4 | C4 | O4 | HO4 | 57.7° | 60.2° |
| H4 | C4 | C5 | C6 | 56.9° | 58.8° |
| H4 | C4 | C5 | O5 | 177.2° | 178.8° |
| H4 | C4 | C5 | H5 | 61.5° | 61.1° |
| C6 | C5 | O5 | H5 | 119.0° | 119.8° |
| C5 | C6 | O6 | H61 | 125.2° | 120.1° |
| C5 | C6 | O6 | H62 | 125.2° | 120.0° |
| C5 | C6 | H61 | H62 | 116.5° | 120.0° |
| C5 | C6 | O6 | HO6 | 180.0° | 180.0° |
| O5 | C5 | C6 | O6 | 175.7° | 64.9° |
| O5 | C5 | C6 | H61 | 50.5° | 55.2° |
| O5 | C5 | C6 | H62 | 59.0° | 175.1° |
| H5 | C5 | C6 | O6 | 62.7° | 55.0° |
| H5 | C5 | C6 | H61 | 172.1° | 175.0° |
| H5 | C5 | C6 | H62 | 62.6° | 65.0° |
| O6 | C6 | H61 | H62 | 116.6° | 120.0° |
| H61 | C6 | O6 | HO6 | 54.8° | 59.9° |
| H62 | C6 | O6 | HO6 | 54.8° | 60.0° |
| O1 | C1' | C2' | C6' | 179.3° | 179.7° |
| O1 | C1' | C2' | C3' | 178.4° | 180.0° |
| O1 | C1' | C2' | H2' | 1.6° | 0.1° |
| O1 | C1' | C6' | C5' | 176.7° | 179.8° |
| O1 | C1' | C6' | H6' | 3.3° | 0.3° |
| C1' | C2' | C3' | H2' | 180.0° | 179.9° |
| C1' | C2' | C3' | C4' | 1.1° | 0.0° |
| C1' | C2' | C3' | H3' | 178.9° | 179.9° |
| C2' | C1' | C6' | C5' | 2.5° | 0.6° |
| C2' | C1' | C6' | H6' | 177.5° | 180.0° |
| C6' | C1' | C2' | C3' | 0.9° | 0.3° |
| C6' | C1' | C2' | H2' | 179.1° | 179.8° |
| C1' | C6' | C5' | C4' | 2.1° | 0.6° |
| C1' | C6' | C5' | H6' | 180.0° | 179.5° |
| C1' | C6' | C5' | H5' | 178.0° | 179.7° |
| C2' | C3' | C4' | H3' | 179.9° | 180.0° |
| C2' | C3' | C4' | C5' | 1.5° | 0.0° |
| C2' | C3' | C4' | N1' | 176.6° | 180.0° |
| H2' | C2' | C3' | C4' | 178.9° | 179.9° |
| H2' | C2' | C3' | H3' | 1.1° | 0.0° |
| C3' | C4' | C5' | N1' | 174.9° | 179.9° |
| C3' | C4' | C5' | C6' | 0.0° | 0.3° |
| C3' | C4' | C5' | H5' | 180.0° | 180.0° |
| C3' | C4' | N1' | O2' | 4.6° | 0.0° |
| C3' | C4' | N1' | O3' | 176.6° | 180.0° |
| H3' | C3' | C4' | C5' | 178.4° | 179.9° |
| H3' | C3' | C4' | N1' | 3.4° | 0.0° |
| C4' | C5' | C6' | H5' | 180.0° | 179.7° |
| C4' | C5' | C6' | H6' | 177.9° | 179.9° |
| C5' | C4' | N1' | O2' | 179.9° | 179.9° |
| C5' | C4' | N1' | O3' | 1.2° | 0.1° |
| N1' | C4' | C5' | C6' | 174.8° | 179.8° |
| N1' | C4' | C5' | H5' | 5.1° | 0.1° |
| C4' | N1' | O2' | O3' | 178.8° | 180.0° |
| H5' | C5' | C6' | H6' | 2.1° | 0.3° |
