63H
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O3P | P | sing | 1.61Å | 1.61Å | |
O3P | HO3P | sing | 0.97Å | 0.95Å | |
O4' | C1' | sing | 1.44Å | 1.43Å | |
C2' | C1' | sing | 1.54Å | 1.51Å | |
N9 | C1' | sing | 1.47Å | 1.48Å | |
C1' | H1' | sing | 1.09Å | 1.10Å | |
O10 | C10 | sing | 1.43Å | 1.43Å | |
H10 | C10 | sing | 1.09Å | 1.10Å | |
C11 | C10 | sing | 1.54Å | 1.51Å | |
C10 | N2 | sing | 1.47Å | 1.40Å | |
H11 | C11 | sing | 1.09Å | 1.10Å | |
H11A | C11 | sing | 1.09Å | 1.10Å | |
C11 | C12 | sing | 1.53Å | 1.51Å | |
H12 | C12 | sing | 1.09Å | 1.10Å | |
C12 | H12A | sing | 1.09Å | 1.10Å | |
C12 | N1 | sing | 1.47Å | 1.42Å | |
N2 | C2 | sing | 1.38Å | 1.38Å | |
N1 | C2 | sing | 1.36Å | 1.40Å | |
C2 | N3 | doub | 1.32Å | 1.33Å | |
H2' | C2' | sing | 1.09Å | 1.10Å | |
C3' | C2' | sing | 1.55Å | 1.52Å | |
C2' | H2'A | sing | 1.09Å | 1.10Å | |
H3' | C3' | sing | 1.09Å | 1.10Å | |
C4' | C3' | sing | 1.55Å | 1.52Å | |
C3' | O3' | sing | 1.43Å | 1.43Å | |
N3 | C4 | sing | 1.34Å | 1.35Å | |
C4 | C5 | doub | 1.40Å | 1.37Å | Aromatic |
C4 | N9 | sing | 1.37Å | 1.38Å | Aromatic |
C5' | C4' | sing | 1.53Å | 1.52Å | |
C4' | O4' | sing | 1.44Å | 1.43Å | |
C4' | H4' | sing | 1.09Å | 1.10Å | |
C6 | C5 | sing | 1.41Å | 1.42Å | |
C5 | N7 | sing | 1.36Å | 1.39Å | Aromatic |
O5' | C5' | sing | 1.43Å | 1.43Å | |
H5'' | C5' | sing | 1.09Å | 1.10Å | |
H5' | C5' | sing | 1.09Å | 1.10Å | |
N1 | C6 | sing | 1.36Å | 1.40Å | |
O6 | C6 | doub | 1.22Å | 1.23Å | |
N9 | C8 | sing | 1.37Å | 1.37Å | Aromatic |
N7 | C8 | doub | 1.30Å | 1.30Å | Aromatic |
C8 | H8 | sing | 1.08Å | 1.08Å | |
HN2 | N2 | sing | 0.97Å | 1.00Å | |
O10 | HO10 | sing | 0.97Å | 0.95Å | |
O1P | P | sing | 1.61Å | 1.48Å | |
O1P | HO1P | sing | 0.97Å | 0.95Å | |
O2P | P | doub | 1.48Å | 1.48Å | |
O3' | HO3' | sing | 0.97Å | 0.95Å | |
P | O5' | sing | 1.61Å | 1.60Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
P | O3P | HO3P | 109.5° | 114.0° |
O3P | P | O1P | 108.9° | 109.5° |
O3P | P | O2P | 107.6° | 109.5° |
O3P | P | O5' | 101.7° | 109.5° |
O4' | C1' | C2' | 104.4° | 107.3° |
O4' | C1' | N9 | 105.9° | 110.0° |
O4' | C1' | H1' | 116.9° | 109.9° |
C1' | O4' | C4' | 109.1° | 107.0° |
C2' | C1' | N9 | 115.1° | 109.8° |
C2' | C1' | H1' | 108.2° | 109.9° |
C1' | C2' | H2' | 110.7° | 110.5° |
C1' | C2' | C3' | 105.9° | 104.2° |
C1' | C2' | H2'A | 111.5° | 110.5° |
N9 | C1' | H1' | 106.6° | 109.9° |
C1' | N9 | C4 | 126.2° | 126.3° |
C1' | N9 | C8 | 128.4° | 126.3° |
O10 | C10 | H10 | 116.8° | 109.9° |
O10 | C10 | C11 | 108.3° | 109.9° |
O10 | C10 | N2 | 104.2° | 109.8° |
C10 | O10 | HO10 | 109.5° | 114.0° |
H10 | C10 | C11 | 103.3° | 109.9° |
H10 | C10 | N2 | 107.4° | 109.9° |
C11 | C10 | N2 | 117.5° | 107.4° |
C10 | C11 | H11 | 108.0° | 109.7° |
C10 | C11 | H11A | 107.0° | 109.7° |
C10 | C11 | C12 | 113.9° | 108.2° |
C10 | N2 | C2 | 124.4° | 119.2° |
C10 | N2 | HN2 | 117.8° | 120.4° |
H11 | C11 | H11A | 113.0° | 109.8° |
H11 | C11 | C12 | 108.0° | 109.7° |
H11A | C11 | C12 | 107.0° | 109.7° |
C11 | C12 | H12 | 105.4° | 109.3° |
C11 | C12 | H12A | 102.3° | 109.2° |
C11 | C12 | N1 | 122.4° | 110.6° |
H12 | C12 | H12A | 120.3° | 109.2° |
H12 | C12 | N1 | 105.3° | 109.2° |
H12A | C12 | N1 | 102.3° | 109.3° |
C12 | N1 | C2 | 117.3° | 122.0° |
C12 | N1 | C6 | 118.7° | 117.9° |
N2 | C2 | N1 | 121.7° | 120.8° |
N2 | C2 | N3 | 115.4° | 117.7° |
C2 | N2 | HN2 | 117.8° | 120.3° |
N1 | C2 | N3 | 122.9° | 121.5° |
C2 | N1 | C6 | 124.0° | 120.0° |
C2 | N3 | C4 | 113.3° | 121.7° |
H2' | C2' | C3' | 110.7° | 110.6° |
H2' | C2' | H2'A | 106.7° | 110.5° |
C3' | C2' | H2'A | 111.4° | 110.5° |
C2' | C3' | H3' | 109.5° | 110.9° |
C2' | C3' | C4' | 103.5° | 102.1° |
C2' | C3' | O3' | 113.7° | 110.9° |
H3' | C3' | C4' | 117.1° | 110.9° |
H3' | C3' | O3' | 107.6° | 110.8° |
C4' | C3' | O3' | 105.5° | 110.9° |
C3' | C4' | C5' | 112.7° | 110.7° |
C3' | C4' | O4' | 108.1° | 103.5° |
C3' | C4' | H4' | 108.8° | 110.6° |
C3' | O3' | HO3' | 109.5° | 114.0° |
N3 | C4 | C5 | 128.0° | 119.5° |
N3 | C4 | N9 | 125.6° | 134.4° |
C5 | C4 | N9 | 106.4° | 106.1° |
C4 | C5 | C6 | 119.9° | 118.5° |
C4 | C5 | N7 | 110.3° | 107.2° |
C4 | N9 | C8 | 105.4° | 107.5° |
C5' | C4' | O4' | 111.1° | 110.7° |
C5' | C4' | H4' | 105.7° | 110.7° |
C4' | C5' | O5' | 111.9° | 109.5° |
C4' | C5' | H5'' | 108.6° | 109.4° |
C4' | C5' | H5' | 108.1° | 109.5° |
O4' | C4' | H4' | 110.5° | 110.6° |
C6 | C5 | N7 | 129.9° | 134.3° |
C5 | C6 | N1 | 112.0° | 118.7° |
C5 | C6 | O6 | 126.8° | 120.6° |
C5 | N7 | C8 | 104.2° | 109.4° |
O5' | C5' | H5'' | 108.7° | 109.4° |
O5' | C5' | H5' | 108.1° | 109.5° |
C5' | O5' | P | 121.6° | 123.0° |
H5'' | C5' | H5' | 111.4° | 109.5° |
N1 | C6 | O6 | 121.2° | 120.6° |
N9 | C8 | N7 | 113.7° | 109.8° |
N9 | C8 | H8 | 123.1° | 125.1° |
N7 | C8 | H8 | 123.1° | 125.1° |
P | O1P | HO1P | 109.5° | 114.0° |
O1P | P | O2P | 120.8° | 109.5° |
O1P | P | O5' | 108.9° | 109.5° |
O2P | P | O5' | 107.4° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O3P | P | O5' | C5' | 68.5° | 64.9° |
O3P | P | O1P | O2P | 125.1° | 120.0° |
O3P | P | O1P | O5' | 110.1° | 120.0° |
O3P | P | O1P | HO1P | 97.2° | 60.0° |
O3P | P | O2P | O5' | 108.8° | 120.0° |
HO3P | O3P | P | O1P | 81.5° | 60.0° |
HO3P | O3P | P | O2P | 51.0° | 180.0° |
HO3P | O3P | P | O5' | 163.7° | 60.0° |
O4' | C1' | C2' | N9 | 115.7° | 119.5° |
O4' | C1' | C2' | H1' | 125.2° | 119.5° |
O4' | C1' | N9 | H1' | 125.3° | 121.1° |
O4' | C1' | C2' | H2' | 148.4° | 120.8° |
O4' | C1' | C2' | C3' | 28.4° | 2.1° |
O4' | C1' | C2' | H2'A | 92.9° | 116.6° |
C1' | O4' | C4' | C3' | 19.6° | 40.1° |
O4' | C1' | N9 | C4 | 65.5° | 156.8° |
C1' | O4' | C4' | C5' | 143.8° | 158.6° |
C1' | O4' | C4' | H4' | 99.3° | 78.4° |
O4' | C1' | N9 | C8 | 112.4° | 23.1° |
C2' | C1' | N9 | H1' | 119.9° | 121.0° |
C1' | C2' | H2' | C3' | 117.1° | 114.8° |
C1' | C2' | H2' | H2'A | 121.5° | 122.6° |
C1' | C2' | C3' | H2'A | 121.4° | 118.6° |
C1' | C2' | C3' | H3' | 142.2° | 97.3° |
C1' | C2' | C3' | C4' | 16.6° | 20.9° |
C1' | C2' | C3' | O3' | 97.4° | 139.1° |
C2' | C1' | N9 | C4 | 49.3° | 85.3° |
C2' | C1' | O4' | C4' | 29.9° | 26.5° |
C2' | C1' | N9 | C8 | 132.8° | 94.8° |
N9 | C1' | C2' | H2' | 95.9° | 119.6° |
N9 | C1' | C2' | C3' | 144.1° | 121.6° |
N9 | C1' | C2' | H2'A | 22.7° | 3.0° |
C1' | N9 | C4 | N3 | 1.8° | 0.8° |
C1' | N9 | C4 | C5 | 178.1° | 179.7° |
C1' | N9 | C4 | C8 | 178.3° | 179.9° |
N9 | C1' | O4' | C4' | 151.8° | 146.0° |
C1' | N9 | C8 | N7 | 178.0° | 179.8° |
C1' | N9 | C8 | H8 | 2.0° | 0.1° |
H1' | C1' | C2' | H2' | 23.2° | 1.3° |
H1' | C1' | C2' | C3' | 96.8° | 117.4° |
H1' | C1' | C2' | H2'A | 141.8° | 123.9° |
H1' | C1' | N9 | C4 | 169.2° | 35.6° |
H1' | C1' | O4' | C4' | 89.6° | 92.9° |
H1' | C1' | N9 | C8 | 12.9° | 144.3° |
O10 | C10 | H10 | C11 | 118.7° | 121.1° |
O10 | C10 | H10 | N2 | 116.5° | 121.0° |
O10 | C10 | C11 | N2 | 117.6° | 119.4° |
O10 | C10 | C11 | H11 | 9.8° | 61.5° |
O10 | C10 | C11 | H11A | 131.8° | 177.9° |
O10 | C10 | C11 | C12 | 110.2° | 58.2° |
O10 | C10 | N2 | C2 | 126.3° | 74.7° |
O10 | C10 | N2 | HN2 | 53.7° | 105.3° |
H10 | C10 | C11 | N2 | 118.0° | 119.5° |
H10 | C10 | C11 | H11 | 114.7° | 59.6° |
H10 | C10 | C11 | H11A | 7.3° | 61.0° |
H10 | C10 | C11 | C12 | 125.4° | 179.3° |
H10 | C10 | N2 | C2 | 109.2° | 164.2° |
H10 | C10 | N2 | HN2 | 70.8° | 15.7° |
H10 | C10 | O10 | HO10 | 34.6° | 61.0° |
C10 | C11 | H11 | H11A | 118.2° | 120.6° |
C10 | C11 | H11 | C12 | 123.7° | 118.8° |
C10 | C11 | H11A | C12 | 122.5° | 118.8° |
C10 | C11 | C12 | H12 | 101.7° | 67.7° |
C10 | C11 | C12 | H12A | 131.7° | 172.9° |
C10 | C11 | C12 | N1 | 18.3° | 52.6° |
C11 | C10 | N2 | C2 | 6.6° | 44.7° |
C11 | C10 | N2 | HN2 | 173.4° | 135.2° |
C11 | C10 | O10 | HO10 | 81.3° | 177.9° |
N2 | C10 | C11 | H11 | 127.4° | 179.1° |
N2 | C10 | C11 | H11A | 110.6° | 58.5° |
N2 | C10 | C11 | C12 | 7.4° | 61.2° |
C10 | N2 | C2 | HN2 | 180.0° | 179.9° |
C10 | N2 | C2 | N1 | 11.2° | 17.7° |
C10 | N2 | C2 | N3 | 169.0° | 164.3° |
N2 | C10 | O10 | HO10 | 152.9° | 60.0° |
H11 | C11 | H11A | C12 | 118.7° | 120.7° |
H11 | C11 | C12 | H12 | 18.3° | 52.0° |
H11 | C11 | C12 | H12A | 108.3° | 67.4° |
H11 | C11 | C12 | N1 | 138.3° | 172.3° |
H11A | C11 | C12 | H12 | 140.3° | 172.7° |
H11A | C11 | C12 | H12A | 13.7° | 53.3° |
H11A | C11 | C12 | N1 | 99.7° | 67.0° |
C11 | C12 | H12 | H12A | 114.6° | 119.4° |
C11 | C12 | H12 | N1 | 130.7° | 121.2° |
C11 | C12 | H12A | N1 | 127.6° | 121.1° |
C11 | C12 | N1 | C2 | 14.9° | 26.2° |
C11 | C12 | N1 | C6 | 165.1° | 154.2° |
H12 | C12 | H12A | N1 | 116.2° | 119.4° |
H12 | C12 | N1 | C2 | 105.1° | 94.1° |
H12 | C12 | N1 | C6 | 74.9° | 85.4° |
H12A | C12 | N1 | C2 | 128.3° | 146.5° |
H12A | C12 | N1 | C6 | 51.7° | 33.9° |
C12 | N1 | C2 | N2 | 0.1° | 7.4° |
C12 | N1 | C2 | C6 | 180.0° | 179.5° |
C12 | N1 | C2 | N3 | 179.9° | 174.6° |
C12 | N1 | C6 | C5 | 180.0° | 175.3° |
C12 | N1 | C6 | O6 | 0.1° | 4.7° |
N2 | C2 | N1 | N3 | 179.9° | 177.9° |
N2 | C2 | N3 | C4 | 179.9° | 175.6° |
N2 | C2 | N1 | C6 | 180.0° | 173.0° |
N1 | C2 | N3 | C4 | 0.1° | 2.4° |
C2 | N1 | C6 | C5 | 0.1° | 4.2° |
C2 | N1 | C6 | O6 | 179.9° | 175.7° |
N1 | C2 | N2 | HN2 | 168.8° | 162.3° |
C2 | N3 | C4 | C5 | 0.1° | 0.7° |
C2 | N3 | C4 | N9 | 179.9° | 179.8° |
N3 | C2 | N1 | C6 | 0.1° | 4.9° |
N3 | C2 | N2 | HN2 | 11.0° | 15.7° |
H2' | C2' | C3' | H2'A | 118.6° | 122.6° |
H2' | C2' | C3' | H3' | 97.8° | 143.9° |
H2' | C2' | C3' | C4' | 136.5° | 97.9° |
H2' | C2' | C3' | O3' | 22.6° | 20.3° |
C2' | C3' | H3' | C4' | 117.4° | 112.7° |
C2' | C3' | H3' | O3' | 124.0° | 123.7° |
C2' | C3' | C4' | O3' | 119.7° | 118.2° |
C2' | C3' | C4' | C5' | 124.2° | 155.6° |
C2' | C3' | C4' | O4' | 1.0° | 37.0° |
C2' | C3' | C4' | H4' | 119.0° | 81.5° |
C2' | C3' | O3' | HO3' | 31.8° | 61.4° |
H2'A | C2' | C3' | H3' | 20.8° | 21.3° |
H2'A | C2' | C3' | C4' | 104.8° | 139.5° |
H2'A | C2' | C3' | O3' | 141.2° | 102.3° |
H3' | C3' | C4' | O3' | 119.7° | 123.5° |
H3' | C3' | C4' | C5' | 3.5° | 37.4° |
H3' | C3' | C4' | O4' | 119.6° | 81.2° |
H3' | C3' | C4' | H4' | 120.4° | 160.3° |
H3' | C3' | O3' | HO3' | 153.2° | 62.3° |
C3' | C4' | C5' | O4' | 121.5° | 114.1° |
C3' | C4' | C5' | H4' | 118.7° | 122.9° |
C3' | C4' | O4' | H4' | 118.9° | 118.4° |
C3' | C4' | C5' | O5' | 55.3° | 175.0° |
C3' | C4' | C5' | H5'' | 175.3° | 65.0° |
C3' | C4' | C5' | H5' | 63.7° | 55.0° |
C4' | C3' | O3' | HO3' | 81.0° | 174.1° |
O3' | C3' | C4' | C5' | 116.1° | 86.2° |
O3' | C3' | C4' | O4' | 120.7° | 155.3° |
O3' | C3' | C4' | H4' | 0.7° | 36.8° |
N3 | C4 | C5 | N9 | 179.8° | 179.6° |
N3 | C4 | C5 | C6 | 0.1° | 1.3° |
N3 | C4 | C5 | N7 | 180.0° | 179.2° |
N3 | C4 | N9 | C8 | 180.0° | 179.1° |
C4 | C5 | C6 | N7 | 180.0° | 179.4° |
C4 | C5 | C6 | N1 | 0.1° | 1.2° |
C4 | C5 | C6 | O6 | 179.9° | 178.7° |
C5 | C4 | N9 | C8 | 0.2° | 0.4° |
C4 | C5 | N7 | C8 | 0.0° | 0.3° |
N9 | C4 | C5 | C6 | 179.9° | 179.1° |
N9 | C4 | C5 | N7 | 0.1° | 0.5° |
C4 | N9 | C8 | N7 | 0.2° | 0.3° |
C4 | N9 | C8 | H8 | 179.8° | 179.8° |
C5' | C4' | O4' | H4' | 116.9° | 123.0° |
C4' | C5' | O5' | H5'' | 120.0° | 119.9° |
C4' | C5' | O5' | H5' | 119.0° | 120.1° |
C4' | C5' | H5'' | H5' | 119.0° | 120.0° |
C4' | C5' | O5' | P | 176.5° | 180.0° |
O4' | C4' | C5' | O5' | 66.2° | 70.9° |
O4' | C4' | C5' | H5'' | 53.8° | 49.1° |
O4' | C4' | C5' | H5' | 174.8° | 169.1° |
H4' | C4' | C5' | O5' | 173.9° | 52.1° |
H4' | C4' | C5' | H5'' | 66.1° | 172.1° |
H4' | C4' | C5' | H5' | 54.9° | 67.9° |
C5 | C6 | N1 | O6 | 179.8° | 180.0° |
C6 | C5 | N7 | C8 | 180.0° | 179.2° |
N7 | C5 | C6 | N1 | 180.0° | 178.2° |
N7 | C5 | C6 | O6 | 0.2° | 1.8° |
C5 | N7 | C8 | N9 | 0.1° | 0.0° |
C5 | N7 | C8 | H8 | 179.9° | 179.9° |
O5' | C5' | H5'' | H5' | 119.0° | 120.0° |
C5' | O5' | P | O1P | 46.4° | 175.0° |
C5' | O5' | P | O2P | 178.7° | 55.1° |
H5'' | C5' | O5' | P | 56.6° | 60.1° |
H5' | C5' | O5' | P | 64.5° | 59.9° |
N9 | C8 | N7 | H8 | 180.0° | 180.0° |
O1P | P | O2P | O5' | 125.5° | 120.0° |
HO1P | O1P | P | O2P | 137.7° | 60.0° |
HO1P | O1P | P | O5' | 12.9° | 179.9° |