8C6
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O3' | C3' | sing | 1.43Å | 1.46Å | |
O | C2' | sing | 1.43Å | 1.46Å | |
C3' | C2' | sing | 1.55Å | 1.46Å | |
C3' | C4' | sing | 1.54Å | 1.48Å | |
C2' | C1' | sing | 1.55Å | 1.47Å | |
O1B | PB | doub | 1.48Å | 1.48Å | |
O2A | PA | sing | 1.61Å | 1.48Å | |
C4' | C5' | sing | 1.53Å | 1.50Å | |
C4' | O4' | sing | 1.44Å | 1.50Å | |
C5' | O5' | sing | 1.43Å | 1.44Å | |
C1' | O4' | sing | 1.44Å | 1.51Å | |
C1' | N9 | sing | 1.46Å | 1.40Å | |
O2B | PB | sing | 1.61Å | 1.49Å | |
PB | C3A | sing | 1.82Å | 1.83Å | |
PB | O3B | sing | 1.61Å | 1.48Å | |
PA | O5' | sing | 1.61Å | 1.62Å | |
PA | C3A | sing | 1.82Å | 1.82Å | |
PA | O1A | doub | 1.48Å | 1.48Å | |
C3A | CL2 | sing | 1.80Å | 1.73Å | |
N9 | C4 | sing | 1.37Å | 1.29Å | Aromatic |
N9 | C8 | sing | 1.36Å | 1.28Å | Aromatic |
N3 | C4 | doub | 1.33Å | 1.34Å | Aromatic |
N3 | C2 | sing | 1.32Å | 1.35Å | Aromatic |
C4 | C5 | sing | 1.41Å | 1.47Å | Aromatic |
C8 | N7 | doub | 1.30Å | 1.37Å | Aromatic |
C2 | N1 | doub | 1.32Å | 1.35Å | Aromatic |
C5 | N7 | sing | 1.35Å | 1.53Å | Aromatic |
C5 | C6 | doub | 1.41Å | 1.39Å | Aromatic |
N1 | C6 | sing | 1.33Å | 1.34Å | Aromatic |
C6 | N6 | sing | 1.38Å | 1.46Å | |
O2B | H1 | sing | 0.97Å | 0.95Å | |
O3B | H2 | sing | 0.97Å | 0.95Å | |
C5' | H4 | sing | 1.09Å | 1.10Å | |
C5' | H5 | sing | 1.09Å | 1.10Å | |
C4' | H6 | sing | 1.09Å | 1.10Å | |
C3' | H7 | sing | 1.09Å | 1.10Å | |
O3' | H8 | sing | 0.97Å | 0.95Å | |
C2' | H9 | sing | 1.09Å | 1.10Å | |
C1' | H10 | sing | 1.09Å | 1.10Å | |
C8 | H11 | sing | 1.08Å | 1.08Å | |
N6 | H12 | sing | 0.97Å | 1.00Å | |
N6 | H13 | sing | 0.97Å | 1.00Å | |
C2 | H14 | sing | 1.08Å | 1.08Å | |
O | H15 | sing | 0.97Å | 0.95Å | |
C3A | H16 | sing | 1.09Å | 1.10Å | |
O2A | H3 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O3' | C3' | C2' | 110.6° | 110.5° |
O3' | C3' | C4' | 110.7° | 110.5° |
O3' | C3' | H7 | 109.6° | 110.6° |
C3' | O3' | H8 | 109.5° | 114.0° |
O | C2' | C3' | 109.6° | 110.9° |
O | C2' | C1' | 109.3° | 111.0° |
O | C2' | H9 | 110.1° | 110.8° |
C2' | O | H15 | 109.5° | 114.1° |
C2' | C3' | C4' | 106.8° | 104.2° |
C3' | C2' | C1' | 107.6° | 102.1° |
C2' | C3' | H7 | 109.7° | 110.5° |
C3' | C2' | H9 | 110.2° | 110.9° |
C3' | C4' | C5' | 110.6° | 109.9° |
C3' | C4' | O4' | 107.1° | 107.3° |
C3' | C4' | H6 | 109.6° | 110.0° |
C4' | C3' | H7 | 109.4° | 110.5° |
C2' | C1' | O4' | 107.8° | 103.5° |
C2' | C1' | N9 | 110.7° | 110.6° |
C1' | C2' | H9 | 110.1° | 110.9° |
C2' | C1' | H10 | 108.9° | 110.6° |
O1B | PB | O2B | 103.7° | 109.5° |
O1B | PB | C3A | 114.6° | 109.4° |
O1B | PB | O3B | 104.8° | 109.5° |
O2A | PA | O5' | 111.2° | 109.5° |
O2A | PA | C3A | 111.6° | 109.4° |
O2A | PA | O1A | 100.8° | 109.5° |
PA | O2A | H3 | 109.5° | 114.0° |
C5' | C4' | O4' | 111.0° | 109.9° |
C4' | C5' | O5' | 110.4° | 109.4° |
C4' | C5' | H4 | 109.3° | 109.4° |
C4' | C5' | H5 | 109.3° | 109.5° |
C5' | C4' | H6 | 109.3° | 109.9° |
C4' | O4' | C1' | 105.0° | 107.0° |
O4' | C4' | H6 | 109.2° | 109.8° |
C5' | O5' | PA | 121.0° | 123.0° |
O5' | C5' | H4 | 109.2° | 109.5° |
O5' | C5' | H5 | 109.2° | 109.5° |
O4' | C1' | N9 | 111.1° | 110.6° |
O4' | C1' | H10 | 108.4° | 110.6° |
C1' | N9 | C4 | 119.1° | 126.3° |
C1' | N9 | C8 | 119.8° | 126.3° |
N9 | C1' | H10 | 109.9° | 110.7° |
O2B | PB | C3A | 114.1° | 109.5° |
O2B | PB | O3B | 104.5° | 109.5° |
PB | O2B | H1 | 109.5° | 114.0° |
C3A | PB | O3B | 114.0° | 109.5° |
PB | C3A | PA | 109.6° | 109.5° |
PB | C3A | CL2 | 109.6° | 109.5° |
PB | C3A | H16 | 109.1° | 109.5° |
PB | O3B | H2 | 109.5° | 114.0° |
O5' | PA | C3A | 111.2° | 109.5° |
O5' | PA | O1A | 110.9° | 109.5° |
C3A | PA | O1A | 110.6° | 109.5° |
PA | C3A | CL2 | 109.2° | 109.5° |
PA | C3A | H16 | 109.1° | 109.5° |
CL2 | C3A | H16 | 110.2° | 109.4° |
C4 | N9 | C8 | 121.1° | 107.4° |
N9 | C4 | N3 | 139.1° | 134.9° |
N9 | C4 | C5 | 103.1° | 106.0° |
N9 | C8 | N7 | 107.2° | 110.0° |
N9 | C8 | H11 | 126.4° | 125.0° |
C4 | N3 | C2 | 119.4° | 120.6° |
N3 | C4 | C5 | 117.8° | 119.1° |
N3 | C2 | N1 | 123.9° | 122.5° |
N3 | C2 | H14 | 118.0° | 118.8° |
C4 | C5 | N7 | 103.6° | 107.2° |
C4 | C5 | C6 | 119.3° | 118.1° |
C8 | N7 | C5 | 105.1° | 109.5° |
N7 | C8 | H11 | 126.4° | 125.1° |
C2 | N1 | C6 | 120.5° | 121.2° |
N1 | C2 | H14 | 118.1° | 118.8° |
N7 | C5 | C6 | 137.0° | 134.7° |
C5 | C6 | N1 | 119.0° | 118.4° |
C5 | C6 | N6 | 120.6° | 120.8° |
N1 | C6 | N6 | 120.5° | 120.8° |
C6 | N6 | H12 | 109.5° | 120.0° |
C6 | N6 | H13 | 109.5° | 120.0° |
H4 | C5' | H5 | 109.5° | 109.5° |
H12 | N6 | H13 | 109.5° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O3' | C3' | C2' | O | 25.0° | 20.4° |
O3' | C3' | C2' | C4' | 120.6° | 118.7° |
O3' | C3' | C2' | H7 | 121.0° | 122.6° |
O3' | C3' | C4' | H7 | 120.9° | 122.7° |
O3' | C3' | C2' | C1' | 143.7° | 97.9° |
O3' | C3' | C4' | C5' | 94.5° | 119.9° |
O3' | C3' | C4' | O4' | 144.4° | 120.7° |
O3' | C3' | C4' | H6 | 26.0° | 1.3° |
O3' | C3' | C2' | H9 | 96.3° | 144.0° |
O | C2' | C3' | C1' | 118.7° | 118.3° |
O | C2' | C3' | H9 | 121.3° | 123.6° |
O | C2' | C3' | C4' | 95.6° | 139.1° |
O | C2' | C1' | H9 | 121.0° | 123.6° |
O | C2' | C1' | O4' | 105.4° | 155.2° |
O | C2' | C1' | N9 | 133.0° | 86.2° |
O | C2' | C3' | H7 | 146.0° | 102.2° |
O | C2' | C1' | H10 | 12.0° | 36.7° |
C2' | C3' | C4' | H7 | 118.6° | 118.6° |
C3' | C2' | C1' | H9 | 120.1° | 118.2° |
C2' | C3' | C4' | C5' | 145.0° | 121.5° |
C2' | C3' | C4' | O4' | 23.8° | 2.0° |
C3' | C2' | C1' | O4' | 13.5° | 37.0° |
C3' | C2' | C1' | N9 | 108.1° | 155.5° |
C2' | C3' | C4' | H6 | 94.5° | 117.4° |
C2' | C3' | O3' | H8 | 180.0° | 61.4° |
C3' | C2' | C1' | H10 | 130.9° | 81.5° |
C3' | C2' | O | H15 | 180.0° | 61.5° |
C4' | C3' | C2' | C1' | 23.1° | 20.8° |
C3' | C4' | C5' | O4' | 118.8° | 117.8° |
C3' | C4' | C5' | H6 | 120.7° | 121.2° |
C3' | C4' | O4' | H6 | 118.6° | 119.6° |
C3' | C4' | C5' | O5' | 76.5° | 175.7° |
C3' | C4' | O4' | C1' | 15.1° | 26.5° |
C3' | C4' | C5' | H4 | 163.4° | 64.3° |
C3' | C4' | C5' | H5 | 43.7° | 55.7° |
C4' | C3' | O3' | H8 | 61.8° | 176.2° |
C4' | C3' | C2' | H9 | 143.1° | 97.3° |
C2' | C1' | O4' | C4' | 1.1° | 40.0° |
C2' | C1' | O4' | N9 | 121.4° | 118.6° |
C2' | C1' | O4' | H10 | 117.8° | 118.4° |
C2' | C1' | N9 | H10 | 120.4° | 122.9° |
C2' | C1' | N9 | C4 | 98.0° | 84.9° |
C2' | C1' | N9 | C8 | 82.1° | 94.7° |
C1' | C2' | C3' | H7 | 95.2° | 139.5° |
C1' | C2' | O | H15 | 62.3° | 174.2° |
O1B | PB | O2B | C3A | 125.3° | 119.9° |
O1B | PB | O2B | O3B | 109.5° | 120.0° |
O1B | PB | C3A | O3B | 120.7° | 120.0° |
O1B | PB | C3A | PA | 52.7° | 60.0° |
O1B | PB | C3A | CL2 | 172.5° | 60.0° |
O1B | PB | O2B | H1 | 0.0° | 179.9° |
O1B | PB | O3B | H2 | 0.0° | 60.0° |
O1B | PB | C3A | H16 | 66.8° | 180.0° |
O2A | PA | O5' | C5' | 66.0° | 65.0° |
O2A | PA | C3A | PB | 49.7° | 60.0° |
O2A | PA | O5' | C3A | 125.1° | 120.0° |
O2A | PA | O5' | O1A | 111.4° | 120.0° |
O2A | PA | C3A | O1A | 111.4° | 120.0° |
O2A | PA | C3A | CL2 | 169.8° | 180.0° |
O2A | PA | C3A | H16 | 69.8° | 60.0° |
C5' | C4' | O4' | H6 | 120.5° | 121.0° |
C4' | C5' | O5' | H4 | 120.1° | 120.0° |
C4' | C5' | O5' | H5 | 120.2° | 120.0° |
C5' | C4' | O4' | C1' | 136.0° | 145.9° |
C4' | C5' | O5' | PA | 143.6° | 180.0° |
C4' | C5' | H4 | H5 | 119.6° | 120.0° |
C5' | C4' | C3' | H7 | 26.4° | 2.8° |
O4' | C4' | C5' | O5' | 42.3° | 66.5° |
C4' | O4' | C1' | N9 | 122.5° | 158.6° |
O4' | C4' | C5' | H4 | 77.8° | 53.5° |
O4' | C4' | C5' | H5 | 162.5° | 173.5° |
O4' | C4' | C3' | H7 | 94.8° | 116.6° |
C4' | O4' | C1' | H10 | 116.7° | 78.4° |
C5' | O5' | PA | C3A | 59.1° | 175.0° |
C5' | O5' | PA | O1A | 177.4° | 55.0° |
O5' | C5' | H4 | H5 | 119.6° | 120.0° |
O5' | C5' | C4' | H6 | 162.8° | 54.5° |
O4' | C1' | N9 | H10 | 119.9° | 122.9° |
O4' | C1' | N9 | C4 | 142.2° | 160.9° |
O4' | C1' | N9 | C8 | 37.7° | 19.4° |
C1' | O4' | C4' | H6 | 103.5° | 93.1° |
O4' | C1' | C2' | H9 | 133.6° | 81.2° |
C1' | N9 | C4 | C8 | 179.9° | 179.7° |
C1' | N9 | C4 | N3 | 0.0° | 0.7° |
C1' | N9 | C4 | C5 | 179.7° | 179.9° |
C1' | N9 | C8 | N7 | 179.8° | 179.9° |
N9 | C1' | C2' | H9 | 12.0° | 37.4° |
C1' | N9 | C8 | H11 | 0.2° | 0.1° |
O2B | PB | C3A | O3B | 120.0° | 120.0° |
O2B | PB | C3A | PA | 172.0° | 60.0° |
O2B | PB | C3A | CL2 | 68.2° | 180.0° |
O2B | PB | O3B | H2 | 108.7° | 60.0° |
O2B | PB | C3A | H16 | 52.5° | 60.1° |
PB | C3A | PA | O5' | 174.5° | 180.0° |
PB | C3A | PA | CL2 | 120.1° | 120.0° |
PB | C3A | PA | H16 | 119.4° | 120.1° |
PB | C3A | PA | O1A | 61.7° | 60.0° |
PB | C3A | CL2 | H16 | 120.1° | 120.0° |
C3A | PB | O2B | H1 | 125.3° | 60.0° |
C3A | PB | O3B | H2 | 126.1° | 180.0° |
O3B | PB | C3A | PA | 68.0° | 180.0° |
O3B | PB | C3A | CL2 | 51.8° | 60.0° |
O3B | PB | O2B | H1 | 109.5° | 60.0° |
O3B | PB | C3A | H16 | 172.5° | 60.0° |
O5' | PA | C3A | O1A | 123.8° | 120.0° |
O5' | PA | C3A | CL2 | 65.4° | 60.0° |
PA | O5' | C5' | H4 | 96.3° | 60.0° |
PA | O5' | C5' | H5 | 23.4° | 60.0° |
O5' | PA | C3A | H16 | 55.1° | 59.9° |
O5' | PA | O2A | H3 | 117.7° | 59.9° |
PA | C3A | CL2 | H16 | 119.8° | 120.0° |
C3A | PA | O2A | H3 | 117.5° | 60.0° |
O1A | PA | C3A | CL2 | 58.4° | 60.0° |
O1A | PA | C3A | H16 | 178.8° | 180.0° |
O1A | PA | O2A | H3 | 0.0° | 180.0° |
N9 | C4 | N3 | C5 | 179.6° | 179.1° |
N9 | C4 | N3 | C2 | 179.5° | 179.6° |
C4 | N9 | C8 | N7 | 0.1° | 0.2° |
N9 | C4 | C5 | N7 | 0.2° | 0.4° |
N9 | C4 | C5 | C6 | 179.9° | 179.8° |
C4 | N9 | C1' | H10 | 22.3° | 38.0° |
C4 | N9 | C8 | H11 | 179.9° | 179.8° |
C8 | N9 | C4 | N3 | 179.9° | 179.6° |
C8 | N9 | C4 | C5 | 0.2° | 0.4° |
N9 | C8 | N7 | H11 | 180.0° | 180.0° |
N9 | C8 | N7 | C5 | 0.1° | 0.0° |
C8 | N9 | C1' | H10 | 157.6° | 142.4° |
C4 | N3 | C2 | N1 | 0.3° | 0.2° |
N3 | C4 | C5 | N7 | 180.0° | 179.7° |
N3 | C4 | C5 | C6 | 0.4° | 0.5° |
C4 | N3 | C2 | H14 | 179.7° | 179.8° |
C2 | N3 | C4 | C5 | 0.1° | 0.5° |
N3 | C2 | N1 | H14 | 180.0° | 180.0° |
N3 | C2 | N1 | C6 | 0.1° | 0.1° |
C4 | C5 | N7 | C8 | 0.2° | 0.2° |
C4 | C5 | N7 | C6 | 179.6° | 179.8° |
C4 | C5 | C6 | N1 | 0.7° | 0.2° |
C4 | C5 | C6 | N6 | 179.1° | 179.7° |
C8 | N7 | C5 | C6 | 179.8° | 180.0° |
C2 | N1 | C6 | C5 | 0.7° | 0.0° |
C2 | N1 | C6 | N6 | 179.2° | 180.0° |
N7 | C5 | C6 | N1 | 179.7° | 180.0° |
N7 | C5 | C6 | N6 | 0.4° | 0.0° |
C5 | N7 | C8 | H11 | 179.9° | 180.0° |
C5 | C6 | N1 | N6 | 179.9° | 179.9° |
C5 | C6 | N6 | H12 | 179.9° | 0.1° |
C5 | C6 | N6 | H13 | 60.1° | 180.0° |
N1 | C6 | N6 | H12 | 0.0° | 180.0° |
N1 | C6 | N6 | H13 | 120.0° | 0.1° |
C6 | N1 | C2 | H14 | 179.9° | 180.0° |
C6 | N6 | H12 | H13 | 120.0° | 179.9° |
H4 | C5' | C4' | H6 | 42.7° | 174.5° |
H5 | C5' | C4' | H6 | 77.0° | 65.5° |
H6 | C4' | C3' | H7 | 146.9° | 123.9° |
H7 | C3' | O3' | H8 | 58.9° | 61.2° |
H7 | C3' | C2' | H9 | 24.7° | 21.4° |
H9 | C2' | C1' | H10 | 109.0° | 160.3° |
H9 | C2' | O | H15 | 58.7° | 62.1° |