5FA
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N9 | C8 | sing | 1.36Å | 1.38Å | Aromatic |
N9 | C4 | sing | 1.37Å | 1.32Å | Aromatic |
N9 | C1' | sing | 1.47Å | 1.49Å | |
C8 | N7 | doub | 1.30Å | 1.28Å | Aromatic |
C8 | H8 | sing | 1.08Å | 1.10Å | |
N7 | C5 | sing | 1.35Å | 1.33Å | Aromatic |
C5 | C6 | sing | 1.41Å | 1.39Å | Aromatic |
C5 | C4 | doub | 1.41Å | 1.39Å | Aromatic |
C6 | N6 | sing | 1.38Å | 1.33Å | |
C6 | N1 | doub | 1.33Å | 1.37Å | Aromatic |
N6 | H61 | sing | 0.97Å | 1.02Å | |
N6 | H62 | sing | 0.97Å | 1.02Å | |
N1 | C2 | sing | 1.32Å | 1.39Å | Aromatic |
C2 | N3 | doub | 1.32Å | 1.34Å | Aromatic |
C2 | H2 | sing | 1.08Å | 1.10Å | |
N3 | C4 | sing | 1.33Å | 1.39Å | Aromatic |
O5' | C5' | sing | 1.43Å | 1.40Å | |
O5' | PA | sing | 1.61Å | 1.59Å | |
C5' | C4' | sing | 1.53Å | 1.50Å | |
C5' | H5'1 | sing | 1.09Å | 1.12Å | |
C5' | H5'2 | sing | 1.09Å | 1.12Å | |
C4' | O4' | sing | 1.45Å | 1.44Å | |
C4' | C3' | sing | 1.54Å | 1.52Å | |
C4' | H4' | sing | 1.09Å | 1.12Å | |
O4' | C1' | sing | 1.44Å | 1.45Å | |
C3' | O3' | sing | 1.43Å | 1.43Å | |
C3' | C2' | sing | 1.55Å | 1.51Å | |
C3' | H3' | sing | 1.09Å | 1.12Å | |
O3' | H3T | sing | 0.97Å | 0.95Å | |
C2' | O2' | sing | 1.43Å | 1.40Å | |
C2' | C1' | sing | 1.54Å | 1.52Å | |
C2' | H2' | sing | 1.09Å | 1.12Å | |
O2' | HO'2 | sing | 0.97Å | 0.95Å | |
C1' | H1' | sing | 1.09Å | 1.11Å | |
PA | O1A | doub | 1.48Å | 1.39Å | |
PA | O2A | sing | 1.61Å | 1.51Å | |
PA | O3A | sing | 1.61Å | 1.47Å | |
O2A | H2A | sing | 0.97Å | 0.95Å | |
O3A | PB | sing | 1.61Å | 1.57Å | |
PB | O1B | doub | 1.48Å | 1.45Å | |
PB | O2B | sing | 1.61Å | 1.50Å | |
PB | O3B | sing | 1.61Å | 1.50Å | |
O2B | H2B | sing | 0.97Å | 0.95Å | |
O3B | PG | sing | 1.61Å | 1.58Å | |
PG | O2G | doub | 1.48Å | 1.51Å | |
PG | O1G | sing | 1.61Å | 1.53Å | |
PG | O3G | sing | 1.61Å | 1.61Å | |
O1G | H1G | sing | 0.97Å | 0.95Å | |
O3G | PD | sing | 1.61Å | 1.47Å | |
PD | O1D | doub | 1.48Å | 1.49Å | |
PD | O2D | sing | 1.61Å | 1.59Å | |
PD | O3D | sing | 1.61Å | 1.60Å | |
O2D | H2D | sing | 0.97Å | 0.95Å | |
O3D | PE | sing | 1.61Å | 1.60Å | |
PE | O1E | doub | 1.48Å | 1.53Å | |
PE | O2E | sing | 1.61Å | 1.56Å | |
PE | O3E | sing | 1.61Å | 1.66Å | |
O2E | H2E | sing | 0.97Å | 0.95Å | |
O3E | H3E | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C8 | N9 | C4 | 108.4° | 107.5° |
C8 | N9 | C1' | 125.0° | 126.3° |
N9 | C8 | N7 | 107.5° | 110.0° |
N9 | C8 | H8 | 129.0° | 125.1° |
C4 | N9 | C1' | 126.6° | 126.3° |
N9 | C4 | C5 | 106.9° | 106.0° |
N9 | C4 | N3 | 129.7° | 134.9° |
N9 | C1' | O4' | 108.8° | 110.4° |
N9 | C1' | C2' | 119.3° | 110.4° |
N9 | C1' | H1' | 101.4° | 110.3° |
N7 | C8 | H8 | 123.5° | 125.0° |
C8 | N7 | C5 | 110.9° | 109.4° |
N7 | C5 | C6 | 136.4° | 134.7° |
N7 | C5 | C4 | 106.3° | 107.1° |
C6 | C5 | C4 | 117.3° | 118.2° |
C5 | C6 | N6 | 126.1° | 120.7° |
C5 | C6 | N1 | 118.7° | 118.4° |
C5 | C4 | N3 | 123.3° | 119.1° |
N6 | C6 | N1 | 115.3° | 120.8° |
C6 | N6 | H61 | 126.1° | 119.9° |
C6 | N6 | H62 | 106.3° | 120.0° |
C6 | N1 | C2 | 122.4° | 121.2° |
H61 | N6 | H62 | 106.4° | 120.0° |
N1 | C2 | N3 | 120.0° | 122.4° |
N1 | C2 | H2 | 121.7° | 118.7° |
N3 | C2 | H2 | 118.3° | 118.8° |
C2 | N3 | C4 | 118.3° | 120.7° |
C5' | O5' | PA | 116.6° | 106.8° |
O5' | C5' | C4' | 108.9° | 109.5° |
O5' | C5' | H5'1 | 112.4° | 109.5° |
O5' | C5' | H5'2 | 112.4° | 109.5° |
O5' | PA | O1A | 108.0° | 109.5° |
O5' | PA | O2A | 115.3° | 109.4° |
O5' | PA | O3A | 105.9° | 109.5° |
C4' | C5' | H5'1 | 112.5° | 109.5° |
C4' | C5' | H5'2 | 112.4° | 109.5° |
C5' | C4' | O4' | 117.1° | 110.4° |
C5' | C4' | C3' | 113.7° | 110.5° |
C5' | C4' | H4' | 99.4° | 110.3° |
H5'1 | C5' | H5'2 | 97.9° | 109.5° |
O4' | C4' | C3' | 105.6° | 104.8° |
O4' | C4' | H4' | 108.7° | 110.4° |
C4' | O4' | C1' | 112.1° | 105.3° |
C3' | C4' | H4' | 112.3° | 110.4° |
C4' | C3' | O3' | 108.6° | 110.5° |
C4' | C3' | C2' | 103.1° | 104.1° |
C4' | C3' | H3' | 115.9° | 110.5° |
O4' | C1' | C2' | 103.6° | 104.9° |
O4' | C1' | H1' | 117.6° | 110.4° |
O3' | C3' | C2' | 114.2° | 110.5° |
O3' | C3' | H3' | 105.0° | 110.4° |
C3' | O3' | H3T | 108.6° | 106.8° |
C2' | C3' | H3' | 110.4° | 110.6° |
C3' | C2' | O2' | 111.7° | 110.5° |
C3' | C2' | C1' | 104.4° | 104.0° |
C3' | C2' | H2' | 111.7° | 110.5° |
O2' | C2' | C1' | 110.6° | 110.8° |
O2' | C2' | H2' | 105.7° | 110.4° |
C2' | O2' | HO'2 | 111.7° | 106.8° |
C1' | C2' | H2' | 112.9° | 110.4° |
C2' | C1' | H1' | 106.8° | 110.4° |
O1A | PA | O2A | 110.6° | 109.5° |
O1A | PA | O3A | 93.8° | 109.5° |
O2A | PA | O3A | 120.7° | 109.5° |
PA | O2A | H2A | 115.3° | 106.8° |
PA | O3A | PB | 152.8° | 106.8° |
O3A | PB | O1B | 94.0° | 109.4° |
O3A | PB | O2B | 121.0° | 109.5° |
O3A | PB | O3B | 100.3° | 109.5° |
O1B | PB | O2B | 109.1° | 109.5° |
O1B | PB | O3B | 104.7° | 109.5° |
O2B | PB | O3B | 123.0° | 109.5° |
PB | O2B | H2B | 121.0° | 106.8° |
PB | O3B | PG | 132.6° | 106.8° |
O3B | PG | O2G | 112.7° | 109.5° |
O3B | PG | O1G | 110.1° | 109.5° |
O3B | PG | O3G | 96.4° | 109.5° |
O2G | PG | O1G | 112.3° | 109.5° |
O2G | PG | O3G | 118.8° | 109.5° |
O1G | PG | O3G | 105.3° | 109.5° |
PG | O1G | H1G | 110.1° | 106.8° |
PG | O3G | PD | 141.4° | 106.8° |
O3G | PD | O1D | 106.2° | 109.5° |
O3G | PD | O2D | 114.0° | 109.4° |
O3G | PD | O3D | 106.2° | 109.5° |
O1D | PD | O2D | 113.6° | 109.5° |
O1D | PD | O3D | 110.4° | 109.5° |
O2D | PD | O3D | 106.3° | 109.5° |
PD | O2D | H2D | 114.0° | 106.8° |
PD | O3D | PE | 127.9° | 106.8° |
O3D | PE | O1E | 104.6° | 109.5° |
O3D | PE | O2E | 111.2° | 109.5° |
O3D | PE | O3E | 105.2° | 109.4° |
O1E | PE | O2E | 113.5° | 109.5° |
O1E | PE | O3E | 106.8° | 109.4° |
O2E | PE | O3E | 114.7° | 109.5° |
PE | O2E | H2E | 111.2° | 106.8° |
PE | O3E | H3E | 105.2° | 106.8° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C8 | N9 | C4 | C1' | 178.9° | 180.0° |
N9 | C8 | N7 | H8 | 180.0° | 180.0° |
N9 | C8 | N7 | C5 | 0.2° | 0.3° |
C8 | N9 | C4 | C5 | 0.2° | 0.3° |
C8 | N9 | C4 | N3 | 179.5° | 179.9° |
C8 | N9 | C1' | O4' | 54.0° | 22.0° |
C8 | N9 | C1' | C2' | 64.5° | 93.5° |
C8 | N9 | C1' | H1' | 178.7° | 144.2° |
C4 | N9 | C8 | N7 | 0.0° | 0.0° |
C4 | N9 | C8 | H8 | 180.0° | 180.0° |
N9 | C4 | C5 | N7 | 0.3° | 0.4° |
N9 | C4 | C5 | C6 | 179.4° | 179.7° |
N9 | C4 | C5 | N3 | 179.4° | 179.9° |
N9 | C4 | N3 | C2 | 178.8° | 180.0° |
C4 | N9 | C1' | O4' | 127.2° | 157.9° |
C4 | N9 | C1' | C2' | 114.3° | 86.5° |
C4 | N9 | C1' | H1' | 2.5° | 35.7° |
C1' | N9 | C8 | N7 | 179.0° | 180.0° |
C1' | N9 | C8 | H8 | 1.0° | 0.0° |
C1' | N9 | C4 | C5 | 178.8° | 179.8° |
C1' | N9 | C4 | N3 | 0.5° | 0.0° |
N9 | C1' | O4' | C4' | 114.2° | 159.4° |
N9 | C1' | O4' | C2' | 127.9° | 118.9° |
N9 | C1' | O4' | H1' | 114.5° | 122.2° |
N9 | C1' | C2' | C3' | 92.0° | 142.7° |
N9 | C1' | C2' | O2' | 147.7° | 98.5° |
N9 | C1' | C2' | H1' | 114.0° | 122.2° |
N9 | C1' | C2' | H2' | 29.5° | 24.2° |
C8 | N7 | C5 | C6 | 179.2° | 179.5° |
C8 | N7 | C5 | C4 | 0.4° | 0.4° |
H8 | C8 | N7 | C5 | 179.7° | 179.8° |
N7 | C5 | C6 | C4 | 179.5° | 179.0° |
N7 | C5 | C6 | N6 | 0.8° | 0.7° |
N7 | C5 | C6 | N1 | 179.2° | 179.5° |
N7 | C5 | C4 | N3 | 179.7° | 179.7° |
C5 | C6 | N6 | N1 | 178.4° | 179.8° |
C5 | C6 | N6 | H61 | 180.0° | 179.8° |
C5 | C6 | N6 | H62 | 54.7° | 0.6° |
C5 | C6 | N1 | C2 | 0.4° | 0.3° |
C6 | C5 | C4 | N3 | 0.0° | 0.5° |
C4 | C5 | C6 | N6 | 178.8° | 179.7° |
C4 | C5 | C6 | N1 | 0.4° | 0.5° |
C5 | C4 | N3 | C2 | 0.4° | 0.2° |
C6 | N6 | H61 | H62 | 125.2° | 179.7° |
N6 | C6 | N1 | C2 | 178.9° | 179.9° |
N1 | C6 | N6 | H61 | 1.5° | 0.0° |
N1 | C6 | N6 | H62 | 123.7° | 179.7° |
C6 | N1 | C2 | N3 | 0.0° | 0.0° |
C6 | N1 | C2 | H2 | 180.0° | 180.0° |
N1 | C2 | N3 | H2 | 180.0° | 180.0° |
N1 | C2 | N3 | C4 | 0.3° | 0.0° |
H2 | C2 | N3 | C4 | 179.7° | 180.0° |
O5' | C5' | C4' | H5'1 | 125.3° | 120.0° |
O5' | C5' | C4' | H5'2 | 125.3° | 120.0° |
O5' | C5' | H5'1 | H5'2 | 118.3° | 120.0° |
O5' | C5' | C4' | O4' | 61.7° | 66.5° |
O5' | C5' | C4' | C3' | 174.5° | 178.1° |
O5' | C5' | C4' | H4' | 54.9° | 55.8° |
C5' | O5' | PA | O1A | 151.3° | 55.0° |
C5' | O5' | PA | O2A | 27.1° | 65.0° |
C5' | O5' | PA | O3A | 109.2° | 175.0° |
PA | O5' | C5' | C4' | 143.1° | 180.0° |
PA | O5' | C5' | H5'1 | 17.8° | 60.0° |
PA | O5' | C5' | H5'2 | 91.6° | 60.0° |
O5' | PA | O1A | O2A | 127.0° | 120.0° |
O5' | PA | O1A | O3A | 108.1° | 120.0° |
O5' | PA | O2A | O3A | 129.3° | 120.0° |
O5' | PA | O2A | H2A | 180.0° | 60.0° |
O5' | PA | O3A | PB | 45.7° | 160.0° |
C4' | C5' | H5'1 | H5'2 | 118.3° | 120.0° |
C5' | C4' | O4' | C3' | 127.8° | 118.9° |
C5' | C4' | O4' | H4' | 111.5° | 122.2° |
C5' | C4' | C3' | H4' | 111.9° | 122.3° |
C5' | C4' | O4' | C1' | 135.1° | 159.4° |
C5' | C4' | C3' | O3' | 83.5° | 98.4° |
C5' | C4' | C3' | C2' | 155.0° | 143.0° |
C5' | C4' | C3' | H3' | 34.3° | 24.2° |
H5'1 | C5' | C4' | O4' | 63.6° | 173.5° |
H5'1 | C5' | C4' | C3' | 60.2° | 58.1° |
H5'1 | C5' | C4' | H4' | 179.8° | 64.2° |
H5'2 | C5' | C4' | O4' | 173.0° | 53.5° |
H5'2 | C5' | C4' | C3' | 49.2° | 61.9° |
H5'2 | C5' | C4' | H4' | 70.3° | 175.8° |
O4' | C4' | C3' | H4' | 118.3° | 118.8° |
O4' | C4' | C3' | O3' | 146.7° | 142.8° |
O4' | C4' | C3' | C2' | 25.2° | 24.1° |
O4' | C4' | C3' | H3' | 95.4° | 94.7° |
C4' | O4' | C1' | C2' | 13.6° | 40.4° |
C4' | O4' | C1' | H1' | 131.2° | 78.4° |
C3' | C4' | O4' | C1' | 7.3° | 40.5° |
C4' | C3' | O3' | C2' | 114.4° | 114.7° |
C4' | C3' | O3' | H3' | 124.5° | 122.6° |
C4' | C3' | C2' | H3' | 124.3° | 118.7° |
C4' | C3' | O3' | H3T | 180.0° | 180.0° |
C4' | C3' | C2' | O2' | 86.2° | 118.8° |
C4' | C3' | C2' | C1' | 33.4° | 0.2° |
C4' | C3' | C2' | H2' | 155.7° | 118.7° |
H4' | C4' | O4' | C1' | 113.4° | 78.3° |
H4' | C4' | C3' | O3' | 28.4° | 24.0° |
H4' | C4' | C3' | C2' | 93.1° | 94.7° |
H4' | C4' | C3' | H3' | 146.3° | 146.5° |
O4' | C1' | C2' | C3' | 29.1° | 23.8° |
O4' | C1' | C2' | O2' | 91.2° | 142.6° |
O4' | C1' | C2' | H1' | 124.9° | 118.9° |
O4' | C1' | C2' | H2' | 150.6° | 94.7° |
O3' | C3' | C2' | H3' | 118.1° | 122.7° |
O3' | C3' | C2' | O2' | 31.4° | 0.1° |
O3' | C3' | C2' | C1' | 150.9° | 118.9° |
O3' | C3' | C2' | H2' | 86.7° | 122.7° |
C2' | C3' | O3' | H3T | 65.6° | 65.3° |
C3' | C2' | O2' | C1' | 115.8° | 114.7° |
C3' | C2' | O2' | H2' | 121.7° | 122.6° |
C3' | C2' | C1' | H2' | 121.6° | 118.5° |
C3' | C2' | O2' | HO'2 | 180.0° | 61.5° |
C3' | C2' | C1' | H1' | 154.0° | 95.1° |
H3' | C3' | O3' | H3T | 55.5° | 57.5° |
H3' | C3' | C2' | O2' | 149.5° | 122.5° |
H3' | C3' | C2' | C1' | 91.0° | 118.5° |
H3' | C3' | C2' | H2' | 31.3° | 0.0° |
O2' | C2' | C1' | H2' | 118.2° | 122.7° |
O2' | C2' | C1' | H1' | 33.7° | 23.7° |
C1' | C2' | O2' | HO'2 | 64.2° | 176.2° |
H2' | C2' | O2' | HO'2 | 58.3° | 61.1° |
H2' | C2' | C1' | H1' | 84.5° | 146.4° |
O1A | PA | O2A | O3A | 107.8° | 120.0° |
O1A | PA | O2A | H2A | 57.2° | 180.0° |
O1A | PA | O3A | PB | 155.6° | 40.0° |
O2A | PA | O3A | PB | 87.6° | 80.0° |
O3A | PA | O2A | H2A | 50.6° | 60.0° |
PA | O3A | PB | O1B | 109.1° | 40.0° |
PA | O3A | PB | O2B | 6.0° | 80.0° |
PA | O3A | PB | O3B | 145.1° | 160.0° |
O3A | PB | O1B | O2B | 124.8° | 120.0° |
O3A | PB | O1B | O3B | 101.8° | 120.0° |
O3A | PB | O2B | O3B | 129.8° | 120.0° |
O3A | PB | O2B | H2B | 180.0° | 60.0° |
O3A | PB | O3B | PG | 88.1° | 165.0° |
O1B | PB | O2B | O3B | 123.0° | 120.0° |
O1B | PB | O2B | H2B | 72.9° | 180.0° |
O1B | PB | O3B | PG | 174.9° | 45.0° |
O2B | PB | O3B | PG | 49.9° | 75.0° |
O3B | PB | O2B | H2B | 50.1° | 60.0° |
PB | O3B | PG | O2G | 123.3° | 45.0° |
PB | O3B | PG | O1G | 3.0° | 75.0° |
PB | O3B | PG | O3G | 111.8° | 165.0° |
O3B | PG | O2G | O1G | 125.1° | 120.0° |
O3B | PG | O2G | O3G | 111.6° | 120.0° |
O3B | PG | O1G | O3G | 102.9° | 120.0° |
O3B | PG | O1G | H1G | 180.0° | 60.0° |
O3B | PG | O3G | PD | 175.3° | 160.0° |
O2G | PG | O1G | O3G | 130.6° | 120.0° |
O2G | PG | O1G | H1G | 53.5° | 180.0° |
O2G | PG | O3G | PD | 55.0° | 40.0° |
O1G | PG | O3G | PD | 71.8° | 80.0° |
O3G | PG | O1G | H1G | 77.1° | 60.0° |
PG | O3G | PD | O1D | 56.9° | 40.0° |
PG | O3G | PD | O2D | 68.9° | 80.0° |
PG | O3G | PD | O3D | 174.4° | 160.0° |
O3G | PD | O1D | O2D | 126.1° | 120.0° |
O3G | PD | O1D | O3D | 114.7° | 120.0° |
O3G | PD | O2D | O3D | 116.7° | 120.0° |
O3G | PD | O2D | H2D | 180.0° | 60.0° |
O3G | PD | O3D | PE | 78.4° | 165.0° |
O1D | PD | O2D | O3D | 121.5° | 120.0° |
O1D | PD | O2D | H2D | 58.2° | 180.0° |
O1D | PD | O3D | PE | 167.0° | 45.0° |
O2D | PD | O3D | PE | 43.4° | 75.0° |
O3D | PD | O2D | H2D | 63.3° | 60.0° |
PD | O3D | PE | O1E | 179.1° | 45.0° |
PD | O3D | PE | O2E | 56.2° | 165.0° |
PD | O3D | PE | O3E | 68.5° | 75.0° |
O3D | PE | O1E | O2E | 121.4° | 120.1° |
O3D | PE | O1E | O3E | 111.2° | 120.0° |
O3D | PE | O2E | O3E | 119.2° | 120.0° |
O3D | PE | O2E | H2E | 180.0° | 180.0° |
O3D | PE | O3E | H3E | 180.0° | 60.0° |
O1E | PE | O2E | O3E | 123.2° | 120.0° |
O1E | PE | O2E | H2E | 62.3° | 60.0° |
O1E | PE | O3E | H3E | 69.2° | 180.0° |
O2E | PE | O3E | H3E | 57.5° | 60.0° |
O3E | PE | O2E | H2E | 60.9° | 60.0° |