5N5
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N6 | C6 | sing | 1.38Å | 1.34Å | |
N7 | C5 | sing | 1.35Å | 1.33Å | Aromatic |
N7 | C8 | doub | 1.30Å | 1.34Å | Aromatic |
C6 | C5 | doub | 1.41Å | 1.39Å | Aromatic |
C6 | N1 | sing | 1.33Å | 1.34Å | Aromatic |
C5 | C4 | sing | 1.41Å | 1.39Å | Aromatic |
C8 | N9 | sing | 1.36Å | 1.34Å | Aromatic |
C2' | O2' | sing | 1.43Å | 1.42Å | |
C2' | C3' | sing | 1.55Å | 1.54Å | |
C2' | C1' | sing | 1.55Å | 1.53Å | |
N1 | C2 | doub | 1.32Å | 1.33Å | Aromatic |
O3' | C3' | sing | 1.43Å | 1.44Å | |
C3' | C4' | sing | 1.54Å | 1.53Å | |
C4 | N9 | sing | 1.37Å | 1.33Å | Aromatic |
C4 | N3 | doub | 1.33Å | 1.35Å | Aromatic |
N9 | C1' | sing | 1.46Å | 1.50Å | |
C2 | N3 | sing | 1.32Å | 1.33Å | Aromatic |
C1' | O4' | sing | 1.44Å | 1.45Å | |
C4' | O4' | sing | 1.44Å | 1.45Å | |
C4' | C5' | sing | 1.53Å | 1.53Å | |
C5' | N5' | sing | 1.47Å | 1.47Å | |
O2' | H1 | sing | 0.97Å | 0.95Å | |
C2' | H2 | sing | 1.09Å | 1.10Å | |
C3' | H3 | sing | 1.09Å | 1.10Å | |
O3' | H4 | sing | 0.97Å | 0.95Å | |
C4' | H5 | sing | 1.09Å | 1.10Å | |
C5' | H6 | sing | 1.09Å | 1.10Å | |
C5' | H7 | sing | 1.09Å | 1.10Å | |
N5' | H8 | sing | 1.01Å | 1.00Å | |
N5' | H9 | sing | 1.01Å | 1.00Å | |
C1' | H11 | sing | 1.09Å | 1.10Å | |
C8 | H12 | sing | 1.08Å | 1.08Å | |
C2 | H13 | sing | 1.08Å | 1.08Å | |
N6 | H14 | sing | 0.97Å | 1.00Å | |
N6 | H15 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N6 | C6 | C5 | 120.8° | 120.8° |
N6 | C6 | N1 | 120.2° | 120.8° |
C6 | N6 | H14 | 109.5° | 119.9° |
C6 | N6 | H15 | 109.5° | 120.0° |
C5 | N7 | C8 | 107.7° | 109.4° |
N7 | C5 | C6 | 133.9° | 134.7° |
N7 | C5 | C4 | 107.4° | 107.2° |
N7 | C8 | N9 | 109.7° | 110.0° |
N7 | C8 | H12 | 125.2° | 125.0° |
C5 | C6 | N1 | 118.9° | 118.4° |
C6 | C5 | C4 | 118.6° | 118.2° |
C6 | N1 | C2 | 120.8° | 121.2° |
C5 | C4 | N9 | 107.5° | 106.0° |
C5 | C4 | N3 | 119.4° | 119.1° |
C8 | N9 | C4 | 107.6° | 107.5° |
C8 | N9 | C1' | 126.6° | 126.3° |
N9 | C8 | H12 | 125.1° | 125.0° |
O2' | C2' | C3' | 110.8° | 110.9° |
O2' | C2' | C1' | 108.5° | 110.9° |
C2' | O2' | H1 | 109.5° | 114.0° |
O2' | C2' | H2 | 112.0° | 110.8° |
C3' | C2' | C1' | 104.5° | 102.1° |
C2' | C3' | O3' | 111.9° | 110.5° |
C2' | C3' | C4' | 102.0° | 104.2° |
C3' | C2' | H2 | 110.3° | 110.9° |
C2' | C3' | H3 | 110.0° | 110.5° |
C2' | C1' | N9 | 110.0° | 110.6° |
C2' | C1' | O4' | 105.5° | 103.5° |
C1' | C2' | H2 | 110.3° | 110.9° |
C2' | C1' | H11 | 109.4° | 110.6° |
N1 | C2 | N3 | 122.1° | 122.5° |
N1 | C2 | H13 | 118.9° | 118.7° |
O3' | C3' | C4' | 111.0° | 110.5° |
O3' | C3' | H3 | 111.4° | 110.5° |
C3' | O3' | H4 | 109.5° | 114.0° |
C3' | C4' | O4' | 102.2° | 107.3° |
C3' | C4' | C5' | 110.4° | 109.9° |
C4' | C3' | H3 | 110.2° | 110.5° |
C3' | C4' | H5 | 111.1° | 109.9° |
N9 | C4 | N3 | 133.2° | 135.0° |
C4 | N9 | C1' | 125.7° | 126.3° |
C4 | N3 | C2 | 120.1° | 120.7° |
N9 | C1' | O4' | 111.6° | 110.6° |
N9 | C1' | H11 | 109.8° | 110.7° |
N3 | C2 | H13 | 118.9° | 118.8° |
C1' | O4' | C4' | 105.3° | 106.9° |
O4' | C1' | H11 | 110.5° | 110.6° |
O4' | C4' | C5' | 109.6° | 109.9° |
O4' | C4' | H5 | 112.3° | 109.9° |
C4' | C5' | N5' | 109.3° | 109.5° |
C5' | C4' | H5 | 111.0° | 110.0° |
C4' | C5' | H6 | 109.5° | 109.4° |
C4' | C5' | H7 | 109.5° | 109.5° |
N5' | C5' | H6 | 109.5° | 109.5° |
N5' | C5' | H7 | 109.5° | 109.5° |
C5' | N5' | H8 | 109.5° | 110.9° |
C5' | N5' | H9 | 109.5° | 111.0° |
H6 | C5' | H7 | 109.5° | 109.5° |
H8 | N5' | H9 | 109.5° | 111.0° |
H14 | N6 | H15 | 109.4° | 120.1° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N6 | C6 | C5 | N7 | 0.1° | 0.0° |
N6 | C6 | C5 | N1 | 179.7° | 179.9° |
N6 | C6 | C5 | C4 | 180.0° | 179.7° |
N6 | C6 | N1 | C2 | 179.8° | 179.7° |
C6 | N6 | H14 | H15 | 120.0° | 180.0° |
N7 | C5 | C6 | C4 | 179.9° | 179.7° |
N7 | C5 | C6 | N1 | 179.6° | 179.9° |
C5 | N7 | C8 | N9 | 0.1° | 0.0° |
N7 | C5 | C4 | N9 | 0.1° | 0.4° |
N7 | C5 | C4 | N3 | 179.9° | 180.0° |
C5 | N7 | C8 | H12 | 179.9° | 179.9° |
C8 | N7 | C5 | C6 | 179.9° | 179.9° |
C8 | N7 | C5 | C4 | 0.0° | 0.3° |
N7 | C8 | N9 | H12 | 180.0° | 179.9° |
N7 | C8 | N9 | C4 | 0.2° | 0.3° |
N7 | C8 | N9 | C1' | 179.8° | 179.9° |
C5 | C6 | N1 | C2 | 0.5° | 0.4° |
C6 | C5 | C4 | N9 | 179.8° | 179.8° |
C6 | C5 | C4 | N3 | 0.2° | 0.3° |
C5 | C6 | N6 | H14 | 179.7° | 0.0° |
C5 | C6 | N6 | H15 | 60.3° | 180.0° |
N1 | C6 | C5 | C4 | 0.3° | 0.4° |
C6 | N1 | C2 | N3 | 0.3° | 0.2° |
C6 | N1 | C2 | H13 | 179.7° | 179.7° |
N1 | C6 | N6 | H14 | 0.0° | 179.8° |
N1 | C6 | N6 | H15 | 120.0° | 0.1° |
C5 | C4 | N9 | C8 | 0.2° | 0.4° |
C5 | C4 | N9 | N3 | 180.0° | 179.4° |
C5 | C4 | N9 | C1' | 179.8° | 179.8° |
C5 | C4 | N3 | C2 | 0.4° | 0.0° |
C8 | N9 | C1' | C2' | 71.9° | 95.0° |
C8 | N9 | C4 | C1' | 179.6° | 179.8° |
C8 | N9 | C4 | N3 | 179.8° | 179.9° |
C8 | N9 | C1' | O4' | 44.9° | 19.1° |
C8 | N9 | C1' | H11 | 167.7° | 142.1° |
O2' | C2' | C3' | C1' | 116.7° | 118.2° |
O2' | C2' | C3' | H2 | 124.6° | 123.6° |
O2' | C2' | C1' | H2 | 123.0° | 123.6° |
O2' | C2' | C3' | O3' | 23.2° | 20.4° |
O2' | C2' | C3' | C4' | 95.5° | 139.1° |
O2' | C2' | C1' | N9 | 115.9° | 86.3° |
O2' | C2' | C1' | O4' | 123.6° | 155.2° |
O2' | C2' | C3' | H3 | 147.6° | 102.2° |
O2' | C2' | C1' | H11 | 4.8° | 36.8° |
C3' | C2' | C1' | H2 | 118.6° | 118.2° |
C2' | C3' | O3' | C4' | 113.3° | 114.8° |
C2' | C3' | O3' | H3 | 123.6° | 122.6° |
C2' | C3' | C4' | H3 | 116.8° | 118.7° |
C3' | C2' | C1' | N9 | 125.8° | 155.5° |
C3' | C2' | C1' | O4' | 5.3° | 37.0° |
C2' | C3' | C4' | O4' | 40.6° | 2.0° |
C2' | C3' | C4' | C5' | 157.1° | 121.5° |
C3' | C2' | O2' | H1 | 180.0° | 61.4° |
C2' | C3' | O3' | H4 | 180.0° | 61.4° |
C2' | C3' | C4' | H5 | 79.3° | 117.4° |
C3' | C2' | C1' | H11 | 113.5° | 81.5° |
C1' | C2' | C3' | O3' | 139.9° | 97.8° |
C1' | C2' | C3' | C4' | 21.2° | 20.9° |
C2' | C1' | N9 | C4 | 108.6° | 84.7° |
C2' | C1' | N9 | O4' | 116.7° | 114.1° |
C2' | C1' | N9 | H11 | 120.4° | 122.9° |
C2' | C1' | O4' | H11 | 118.1° | 118.5° |
C2' | C1' | O4' | C4' | 31.8° | 40.1° |
C1' | C2' | O2' | H1 | 65.8° | 174.1° |
C1' | C2' | C3' | H3 | 95.7° | 139.6° |
N1 | C2 | N3 | C4 | 0.2° | 0.0° |
N1 | C2 | N3 | H13 | 180.0° | 179.9° |
O3' | C3' | C4' | H3 | 123.9° | 122.6° |
O3' | C3' | C4' | O4' | 159.9° | 120.7° |
O3' | C3' | C4' | C5' | 83.6° | 119.9° |
O3' | C3' | C2' | H2 | 101.4° | 144.0° |
O3' | C3' | C4' | H5 | 40.0° | 1.3° |
C3' | C4' | O4' | C1' | 45.6° | 26.5° |
C3' | C4' | O4' | C5' | 117.1° | 119.4° |
C3' | C4' | O4' | H5 | 119.1° | 119.5° |
C3' | C4' | C5' | H5 | 123.6° | 121.1° |
C3' | C4' | C5' | N5' | 169.0° | 175.0° |
C4' | C3' | C2' | H2 | 139.9° | 97.4° |
C4' | C3' | O3' | H4 | 66.7° | 176.2° |
C3' | C4' | C5' | H6 | 49.0° | 55.0° |
C3' | C4' | C5' | H7 | 71.0° | 65.0° |
N9 | C4 | N3 | C2 | 179.6° | 179.4° |
C4 | N9 | C1' | O4' | 134.7° | 161.2° |
C4 | N9 | C1' | H11 | 11.9° | 38.2° |
C4 | N9 | C8 | H12 | 179.8° | 179.8° |
N3 | C4 | N9 | C1' | 0.2° | 0.3° |
C4 | N3 | C2 | H13 | 179.8° | 179.9° |
N9 | C1' | O4' | H11 | 122.4° | 123.1° |
N9 | C1' | O4' | C4' | 151.3° | 158.5° |
N9 | C1' | C2' | H2 | 7.2° | 37.3° |
C1' | N9 | C8 | H12 | 0.2° | 0.0° |
C1' | O4' | C4' | C5' | 162.7° | 146.0° |
O4' | C1' | C2' | H2 | 113.4° | 81.2° |
C1' | O4' | C4' | H5 | 73.4° | 92.9° |
O4' | C4' | C5' | H5 | 124.6° | 121.0° |
O4' | C4' | C5' | N5' | 79.2° | 67.1° |
O4' | C4' | C3' | H3 | 76.2° | 116.7° |
O4' | C4' | C5' | H6 | 160.8° | 172.8° |
O4' | C4' | C5' | H7 | 40.7° | 52.9° |
C4' | O4' | C1' | H11 | 86.3° | 78.4° |
C4' | C5' | N5' | H6 | 120.0° | 120.0° |
C4' | C5' | N5' | H7 | 120.0° | 120.0° |
C5' | C4' | C3' | H3 | 40.3° | 2.8° |
C4' | C5' | H6 | H7 | 120.1° | 120.0° |
C4' | C5' | N5' | H8 | 180.0° | 56.0° |
C4' | C5' | N5' | H9 | 60.0° | 180.0° |
N5' | C5' | C4' | H5 | 45.4° | 53.9° |
N5' | C5' | H6 | H7 | 120.0° | 120.0° |
C5' | N5' | H8 | H9 | 120.0° | 123.9° |
H1 | O2' | C2' | H2 | 56.3° | 62.2° |
H2 | C2' | C3' | H3 | 22.9° | 21.4° |
H2 | C2' | C1' | H11 | 127.8° | 160.4° |
H3 | C3' | O3' | H4 | 56.4° | 61.2° |
H3 | C3' | C4' | H5 | 163.9° | 123.9° |
H5 | C4' | C5' | H6 | 74.6° | 66.1° |
H5 | C4' | C5' | H7 | 165.3° | 173.9° |
H6 | C5' | N5' | H8 | 60.0° | 63.9° |
H6 | C5' | N5' | H9 | 180.0° | 60.0° |
H7 | C5' | N5' | H8 | 60.1° | 176.0° |
H7 | C5' | N5' | H9 | 60.0° | 60.0° |