F3A
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C2 | N1 | doub | 1.32Å | 1.39Å | Aromatic |
N1 | C6 | sing | 1.33Å | 1.36Å | Aromatic |
C2 | N3 | sing | 1.32Å | 1.40Å | Aromatic |
C2 | H2 | sing | 1.08Å | 1.08Å | |
N3 | C4 | doub | 1.33Å | 1.36Å | Aromatic |
C4 | C5 | sing | 1.41Å | 1.40Å | Aromatic |
C4 | N9 | sing | 1.37Å | 1.37Å | Aromatic |
C6 | C5 | doub | 1.41Å | 1.39Å | Aromatic |
C5 | N7 | sing | 1.36Å | 1.40Å | Aromatic |
C6 | N6 | sing | 1.38Å | 1.44Å | |
N6 | HN6 | sing | 0.97Å | 1.00Å | |
N6 | HN6A | sing | 0.97Å | 1.00Å | |
N7 | C8 | doub | 1.30Å | 1.37Å | Aromatic |
N9 | C8 | sing | 1.36Å | 1.43Å | Aromatic |
C8 | H8 | sing | 1.08Å | 1.08Å | |
C1' | N9 | sing | 1.47Å | 1.43Å | |
O5' | PA | sing | 1.61Å | 1.58Å | |
C3A | PA | sing | 1.82Å | 1.85Å | |
PA | O2A | doub | 1.48Å | 1.49Å | |
PA | O1A | sing | 1.61Å | 1.54Å | |
O1B | PB | doub | 1.48Å | 1.54Å | |
PB | O2B | sing | 1.61Å | 1.49Å | |
PB | C3A | sing | 1.82Å | 1.85Å | |
PB | O3B | sing | 1.61Å | 1.57Å | |
O3B | PG | sing | 1.61Å | 1.57Å | |
PG | O2G | doub | 1.48Å | 1.56Å | |
PG | O3G | sing | 1.61Å | 1.50Å | |
PG | O1G | sing | 1.61Å | 1.56Å | |
C2' | C1' | sing | 1.54Å | 1.52Å | |
C1' | O4' | sing | 1.44Å | 1.49Å | |
C1' | H1' | sing | 1.09Å | 1.10Å | |
F1A | C3A | sing | 1.40Å | 1.35Å | |
O1A | HO1A | sing | 0.97Å | 0.95Å | |
O1G | HO1G | sing | 0.97Å | 0.95Å | |
C2' | C3' | sing | 1.54Å | 1.47Å | |
C2' | H2' | sing | 1.09Å | 1.10Å | |
C2' | H2'A | sing | 1.09Å | 1.10Å | |
C3A | F2A | sing | 1.40Å | 1.34Å | |
O2B | HO2B | sing | 0.97Å | 0.95Å | |
O3' | C3' | sing | 1.43Å | 1.38Å | |
C3' | C4' | sing | 1.55Å | 1.52Å | |
C3' | H3' | sing | 1.09Å | 1.10Å | |
O3' | HO3' | sing | 0.97Å | 0.95Å | |
O3G | HO3G | sing | 0.97Å | 0.95Å | |
O4' | C4' | sing | 1.44Å | 1.49Å | |
C4' | C5' | sing | 1.53Å | 1.49Å | |
C4' | H4' | sing | 1.09Å | 1.10Å | |
C5' | O5' | sing | 1.43Å | 1.39Å | |
C5' | H5' | sing | 1.09Å | 1.10Å | |
C5' | H5'A | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | N1 | C6 | 120.6° | 121.2° |
N1 | C2 | N3 | 120.6° | 122.5° |
N1 | C2 | H2 | 119.7° | 118.7° |
N1 | C6 | C5 | 119.4° | 118.5° |
N1 | C6 | N6 | 121.2° | 120.8° |
N3 | C2 | H2 | 119.7° | 118.8° |
C2 | N3 | C4 | 118.5° | 120.7° |
N3 | C4 | C5 | 121.1° | 119.0° |
N3 | C4 | N9 | 131.9° | 135.0° |
C5 | C4 | N9 | 107.0° | 106.0° |
C4 | C5 | C6 | 119.9° | 118.2° |
C4 | C5 | N7 | 108.7° | 107.1° |
C4 | N9 | C8 | 109.1° | 107.5° |
C4 | N9 | C1' | 126.0° | 126.3° |
C6 | C5 | N7 | 131.4° | 134.7° |
C5 | C6 | N6 | 119.3° | 120.8° |
C5 | N7 | C8 | 108.0° | 109.5° |
C6 | N6 | HN6 | 109.5° | 120.0° |
C6 | N6 | HN6A | 109.4° | 120.0° |
HN6 | N6 | HN6A | 109.5° | 120.0° |
N7 | C8 | N9 | 107.3° | 110.0° |
N7 | C8 | H8 | 126.3° | 125.0° |
N9 | C8 | H8 | 126.4° | 125.0° |
C8 | N9 | C1' | 124.0° | 126.2° |
N9 | C1' | C2' | 125.2° | 110.4° |
N9 | C1' | O4' | 123.3° | 110.4° |
N9 | C1' | H1' | 77.1° | 110.3° |
O5' | PA | C3A | 109.9° | 109.5° |
O5' | PA | O2A | 105.9° | 109.5° |
O5' | PA | O1A | 108.9° | 109.5° |
PA | O5' | C5' | 121.5° | 123.0° |
C3A | PA | O2A | 109.4° | 109.4° |
C3A | PA | O1A | 113.4° | 109.5° |
PA | C3A | PB | 116.6° | 109.5° |
PA | C3A | F1A | 105.2° | 109.5° |
PA | C3A | F2A | 109.2° | 109.5° |
O2A | PA | O1A | 109.1° | 109.5° |
PA | O1A | HO1A | 109.5° | 114.0° |
O1B | PB | O2B | 108.7° | 109.4° |
O1B | PB | C3A | 107.4° | 109.5° |
O1B | PB | O3B | 108.2° | 109.4° |
O2B | PB | C3A | 114.8° | 109.5° |
O2B | PB | O3B | 109.0° | 109.5° |
PB | O2B | HO2B | 109.5° | 114.0° |
C3A | PB | O3B | 108.6° | 109.5° |
PB | C3A | F1A | 110.7° | 109.5° |
PB | C3A | F2A | 105.5° | 109.4° |
PB | O3B | PG | 122.0° | 134.0° |
O3B | PG | O2G | 110.0° | 109.5° |
O3B | PG | O3G | 108.6° | 109.5° |
O3B | PG | O1G | 110.5° | 109.5° |
O2G | PG | O3G | 112.2° | 109.5° |
O2G | PG | O1G | 108.5° | 109.4° |
O3G | PG | O1G | 107.0° | 109.5° |
PG | O3G | HO3G | 109.5° | 114.0° |
PG | O1G | HO1G | 109.5° | 114.0° |
C2' | C1' | O4' | 102.5° | 104.8° |
C2' | C1' | H1' | 111.6° | 110.4° |
C1' | C2' | C3' | 100.9° | 104.1° |
C1' | C2' | H2' | 112.4° | 110.5° |
C1' | C2' | H2'A | 112.4° | 110.5° |
O4' | C1' | H1' | 114.7° | 110.4° |
C1' | O4' | C4' | 104.4° | 105.3° |
F1A | C3A | F2A | 109.5° | 109.4° |
C3' | C2' | H2' | 112.4° | 110.5° |
C3' | C2' | H2'A | 112.4° | 110.5° |
C2' | C3' | O3' | 119.4° | 110.5° |
C2' | C3' | C4' | 103.4° | 104.1° |
C2' | C3' | H3' | 111.1° | 110.5° |
H2' | C2' | H2'A | 106.4° | 110.6° |
O3' | C3' | C4' | 118.7° | 110.5° |
O3' | C3' | H3' | 92.1° | 110.6° |
C3' | O3' | HO3' | 109.5° | 114.0° |
C4' | C3' | H3' | 111.9° | 110.5° |
C3' | C4' | O4' | 106.6° | 104.8° |
C3' | C4' | C5' | 117.0° | 110.4° |
C3' | C4' | H4' | 109.4° | 110.4° |
O4' | C4' | C5' | 117.0° | 110.4° |
O4' | C4' | H4' | 109.4° | 110.5° |
C5' | C4' | H4' | 96.8° | 110.3° |
C4' | C5' | O5' | 110.2° | 109.5° |
C4' | C5' | H5' | 109.2° | 109.5° |
C4' | C5' | H5'A | 109.2° | 109.5° |
O5' | C5' | H5' | 109.2° | 109.5° |
O5' | C5' | H5'A | 109.2° | 109.5° |
H5' | C5' | H5'A | 109.7° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N1 | C2 | N3 | H2 | 180.0° | 180.0° |
N1 | C2 | N3 | C4 | 0.3° | 0.0° |
C2 | N1 | C6 | C5 | 0.6° | 0.0° |
C2 | N1 | C6 | N6 | 177.5° | 180.0° |
C6 | N1 | C2 | N3 | 0.4° | 0.0° |
C6 | N1 | C2 | H2 | 179.6° | 180.0° |
N1 | C6 | C5 | C4 | 0.6° | 0.1° |
N1 | C6 | C5 | N6 | 177.0° | 180.0° |
N1 | C6 | C5 | N7 | 179.4° | 180.0° |
N1 | C6 | N6 | HN6 | 0.0° | 0.0° |
N1 | C6 | N6 | HN6A | 120.0° | 180.0° |
C2 | N3 | C4 | C5 | 0.3° | 0.1° |
C2 | N3 | C4 | N9 | 178.6° | 180.0° |
H2 | C2 | N3 | C4 | 179.8° | 180.0° |
N3 | C4 | C5 | N9 | 179.2° | 180.0° |
N3 | C4 | C5 | C6 | 0.5° | 0.1° |
N3 | C4 | C5 | N7 | 179.5° | 180.0° |
N3 | C4 | N9 | C8 | 178.7° | 180.0° |
N3 | C4 | N9 | C1' | 9.7° | 0.1° |
C4 | C5 | C6 | N7 | 180.0° | 179.9° |
C4 | C5 | C6 | N6 | 177.6° | 180.0° |
C4 | C5 | N7 | C8 | 0.1° | 0.0° |
C5 | C4 | N9 | C8 | 2.2° | 0.0° |
C5 | C4 | N9 | C1' | 171.3° | 180.0° |
N9 | C4 | C5 | C6 | 178.7° | 179.9° |
N9 | C4 | C5 | N7 | 1.3° | 0.0° |
C4 | N9 | C8 | N7 | 2.3° | 0.0° |
C4 | N9 | C8 | C1' | 169.3° | 179.9° |
C4 | N9 | C8 | H8 | 177.7° | 180.0° |
C4 | N9 | C1' | C2' | 79.2° | 88.2° |
C4 | N9 | C1' | O4' | 139.6° | 156.5° |
C4 | N9 | C1' | H1' | 28.3° | 34.1° |
C5 | C6 | N6 | HN6 | 176.9° | 180.0° |
C5 | C6 | N6 | HN6A | 63.1° | 0.0° |
C6 | C5 | N7 | C8 | 179.9° | 179.9° |
N7 | C5 | C6 | N6 | 2.4° | 0.1° |
C5 | N7 | C8 | N9 | 1.5° | 0.0° |
C5 | N7 | C8 | H8 | 178.5° | 180.0° |
C6 | N6 | HN6 | HN6A | 120.0° | 180.0° |
N7 | C8 | N9 | H8 | 180.0° | 179.9° |
N7 | C8 | N9 | C1' | 171.7° | 180.0° |
C8 | N9 | C1' | C2' | 88.3° | 91.9° |
C8 | N9 | C1' | O4' | 52.9° | 23.5° |
C8 | N9 | C1' | H1' | 164.1° | 145.8° |
H8 | C8 | N9 | C1' | 8.3° | 0.1° |
N9 | C1' | C2' | O4' | 147.6° | 118.9° |
N9 | C1' | C2' | H1' | 89.2° | 122.2° |
N9 | C1' | O4' | H1' | 90.5° | 122.3° |
N9 | C1' | C2' | C3' | 100.5° | 142.8° |
N9 | C1' | C2' | H2' | 139.5° | 98.5° |
N9 | C1' | C2' | H2'A | 19.5° | 24.2° |
N9 | C1' | O4' | C4' | 114.7° | 159.4° |
O5' | PA | C3A | O2A | 115.8° | 120.0° |
O5' | PA | C3A | O1A | 122.2° | 120.0° |
O5' | PA | O2A | O1A | 117.0° | 120.0° |
O5' | PA | C3A | PB | 78.1° | 180.0° |
O5' | PA | C3A | F1A | 45.0° | 60.0° |
O5' | PA | O1A | HO1A | 115.1° | 60.0° |
O5' | PA | C3A | F2A | 162.5° | 60.0° |
PA | O5' | C5' | C4' | 146.3° | 180.0° |
PA | O5' | C5' | H5' | 93.7° | 60.0° |
PA | O5' | C5' | H5'A | 26.3° | 60.0° |
C3A | PA | O2A | O1A | 124.6° | 120.0° |
PA | C3A | PB | O1B | 116.5° | 60.0° |
PA | C3A | PB | O2B | 4.5° | 60.0° |
PA | C3A | PB | F1A | 120.2° | 120.0° |
PA | C3A | PB | F2A | 121.3° | 120.0° |
PA | C3A | PB | O3B | 126.7° | 180.0° |
PA | C3A | F1A | F2A | 117.3° | 120.0° |
C3A | PA | O1A | HO1A | 122.1° | 60.1° |
C3A | PA | O5' | C5' | 84.7° | 175.0° |
O2A | PA | C3A | PB | 166.0° | 60.0° |
O2A | PA | C3A | F1A | 70.9° | 180.0° |
O2A | PA | O1A | HO1A | 0.0° | 180.0° |
O2A | PA | C3A | F2A | 46.6° | 60.0° |
O2A | PA | O5' | C5' | 157.2° | 55.0° |
O1A | PA | C3A | PB | 44.0° | 60.0° |
O1A | PA | C3A | F1A | 167.1° | 60.0° |
O1A | PA | C3A | F2A | 75.4° | 180.0° |
O1A | PA | O5' | C5' | 40.1° | 65.0° |
O1B | PB | O2B | C3A | 120.2° | 120.0° |
O1B | PB | O2B | O3B | 117.8° | 120.0° |
O1B | PB | C3A | O3B | 116.8° | 120.0° |
O1B | PB | O3B | PG | 169.7° | 60.0° |
O1B | PB | C3A | F1A | 3.7° | 60.0° |
O1B | PB | C3A | F2A | 122.2° | 180.0° |
O1B | PB | O2B | HO2B | 0.0° | 180.0° |
O2B | PB | C3A | O3B | 122.2° | 120.1° |
O2B | PB | O3B | PG | 51.6° | 60.0° |
O2B | PB | C3A | F1A | 124.7° | 180.0° |
O2B | PB | C3A | F2A | 116.8° | 60.1° |
C3A | PB | O3B | PG | 74.0° | 180.0° |
PB | C3A | F1A | F2A | 116.0° | 119.9° |
C3A | PB | O2B | HO2B | 120.2° | 60.1° |
PB | O3B | PG | O2G | 111.1° | 40.0° |
PB | O3B | PG | O3G | 12.1° | 80.0° |
PB | O3B | PG | O1G | 129.1° | 160.0° |
O3B | PB | C3A | F1A | 113.1° | 60.0° |
O3B | PB | C3A | F2A | 5.4° | 60.0° |
O3B | PB | O2B | HO2B | 117.8° | 60.0° |
O3B | PG | O2G | O3G | 121.1° | 120.0° |
O3B | PG | O2G | O1G | 120.9° | 120.0° |
O3B | PG | O3G | O1G | 119.3° | 120.0° |
O3B | PG | O1G | HO1G | 120.7° | 180.0° |
O3B | PG | O3G | HO3G | 121.9° | 60.0° |
O2G | PG | O3G | O1G | 118.9° | 120.0° |
O2G | PG | O1G | HO1G | 0.0° | 60.0° |
O2G | PG | O3G | HO3G | 0.0° | 180.0° |
O3G | PG | O1G | HO1G | 121.3° | 60.0° |
O1G | PG | O3G | HO3G | 118.9° | 60.0° |
C2' | C1' | O4' | H1' | 121.1° | 118.9° |
C1' | C2' | C3' | H2' | 120.0° | 118.7° |
C1' | C2' | C3' | H2'A | 120.0° | 118.6° |
C1' | C2' | H2' | H2'A | 123.5° | 122.7° |
C1' | C2' | C3' | O3' | 175.6° | 118.7° |
C1' | C2' | C3' | C4' | 41.1° | 0.0° |
C1' | C2' | C3' | H3' | 79.1° | 118.6° |
C2' | C1' | O4' | C4' | 33.7° | 40.5° |
O4' | C1' | C2' | C3' | 47.0° | 24.0° |
O4' | C1' | C2' | H2' | 73.0° | 142.6° |
O4' | C1' | C2' | H2'A | 167.0° | 94.7° |
C1' | O4' | C4' | C3' | 8.4° | 40.5° |
C1' | O4' | C4' | C5' | 124.7° | 159.4° |
C1' | O4' | C4' | H4' | 126.7° | 78.3° |
H1' | C1' | C2' | C3' | 170.2° | 94.9° |
H1' | C1' | C2' | H2' | 50.2° | 23.7° |
H1' | C1' | C2' | H2'A | 69.8° | 146.4° |
H1' | C1' | O4' | C4' | 154.8° | 78.4° |
C3' | C2' | H2' | H2'A | 123.5° | 122.7° |
C2' | C3' | O3' | C4' | 127.8° | 114.7° |
C2' | C3' | O3' | H3' | 115.7° | 122.7° |
C2' | C3' | C4' | H3' | 119.6° | 118.6° |
C2' | C3' | O3' | HO3' | 135.6° | 61.5° |
C2' | C3' | C4' | O4' | 21.0° | 24.0° |
C2' | C3' | C4' | C5' | 154.1° | 142.8° |
C2' | C3' | C4' | H4' | 97.3° | 95.0° |
H2' | C2' | C3' | O3' | 55.6° | 0.0° |
H2' | C2' | C3' | C4' | 78.9° | 118.7° |
H2' | C2' | C3' | H3' | 160.9° | 122.8° |
H2'A | C2' | C3' | O3' | 64.4° | 122.7° |
H2'A | C2' | C3' | C4' | 161.1° | 118.6° |
H2'A | C2' | C3' | H3' | 40.9° | 0.0° |
O3' | C3' | C4' | H3' | 105.4° | 122.7° |
O3' | C3' | C4' | O4' | 155.9° | 142.6° |
O3' | C3' | C4' | C5' | 71.0° | 98.5° |
O3' | C3' | C4' | H4' | 37.7° | 23.7° |
C4' | C3' | O3' | HO3' | 96.6° | 176.1° |
C3' | C4' | O4' | C5' | 133.1° | 118.8° |
C3' | C4' | O4' | H4' | 118.3° | 118.9° |
C3' | C4' | C5' | H4' | 115.9° | 122.2° |
C3' | C4' | C5' | O5' | 65.4° | 175.0° |
C3' | C4' | C5' | H5' | 174.6° | 55.0° |
C3' | C4' | C5' | H5'A | 54.6° | 65.0° |
H3' | C3' | O3' | HO3' | 19.9° | 61.2° |
H3' | C3' | C4' | O4' | 98.7° | 94.6° |
H3' | C3' | C4' | C5' | 34.5° | 24.2° |
H3' | C3' | C4' | H4' | 143.1° | 146.4° |
O4' | C4' | C5' | H4' | 115.8° | 122.4° |
O4' | C4' | C5' | O5' | 62.9° | 69.6° |
O4' | C4' | C5' | H5' | 57.1° | 170.4° |
O4' | C4' | C5' | H5'A | 177.1° | 50.4° |
C4' | C5' | O5' | H5' | 120.0° | 120.0° |
C4' | C5' | O5' | H5'A | 120.0° | 120.0° |
C4' | C5' | H5' | H5'A | 119.7° | 120.0° |
H4' | C4' | C5' | O5' | 178.8° | 52.7° |
H4' | C4' | C5' | H5' | 58.8° | 67.3° |
H4' | C4' | C5' | H5'A | 61.2° | 172.8° |
O5' | C5' | H5' | H5'A | 119.7° | 120.0° |