FF4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O2 | C2 | doub | 1.22Å | 1.21Å | |
| C2 | N3 | sing | 1.33Å | 1.33Å | |
| C2 | N1 | sing | 1.35Å | 1.33Å | |
| C2' | C1' | sing | 1.54Å | 1.29Å | |
| C2' | C3' | sing | 1.55Å | 1.55Å | |
| N3 | C4 | doub | 1.33Å | 1.34Å | |
| C1' | N1 | sing | 1.47Å | 1.49Å | |
| C1' | O4' | sing | 1.44Å | 1.59Å | |
| N1 | C6 | sing | 1.36Å | 1.33Å | |
| O3' | C3' | sing | 1.43Å | 1.38Å | |
| C4 | N4 | sing | 1.38Å | 1.48Å | |
| C4 | C5 | sing | 1.41Å | 1.39Å | |
| C3' | C4' | sing | 1.54Å | 1.51Å | |
| O4' | C4' | sing | 1.44Å | 1.30Å | |
| C4' | C5' | sing | 1.53Å | 1.60Å | |
| C6 | C5 | doub | 1.35Å | 1.40Å | |
| O2B | PB | doub | 1.48Å | 1.50Å | |
| C5' | O5' | sing | 1.43Å | 1.41Å | |
| PB | O3A | sing | 1.61Å | 1.62Å | |
| PB | O1B | sing | 1.61Å | 1.51Å | |
| PB | C3B | sing | 1.82Å | 1.89Å | |
| O5' | PA | sing | 1.61Å | 1.64Å | |
| O3A | PA | sing | 1.61Å | 1.66Å | |
| C3B | F4B | sing | 1.40Å | 1.35Å | |
| C3B | PG | sing | 1.82Å | 1.84Å | |
| PA | O2A | doub | 1.48Å | 1.50Å | |
| PA | O1A | sing | 1.61Å | 1.51Å | |
| O3G | PG | doub | 1.48Å | 1.48Å | |
| PG | O2G | sing | 1.61Å | 1.52Å | |
| PG | O1G | sing | 1.61Å | 1.49Å | |
| N4 | H1 | sing | 0.97Å | 1.00Å | |
| N4 | H2 | sing | 0.97Å | 1.00Å | |
| C5 | H3 | sing | 1.08Å | 1.08Å | |
| C6 | H4 | sing | 1.08Å | 1.08Å | |
| C1' | H5 | sing | 1.09Å | 1.10Å | |
| C2' | H6 | sing | 1.09Å | 1.10Å | |
| C2' | H7 | sing | 1.09Å | 1.10Å | |
| C3' | H8 | sing | 1.09Å | 1.10Å | |
| O3' | H9 | sing | 0.97Å | 0.95Å | |
| C4' | H10 | sing | 1.09Å | 1.10Å | |
| C5' | H11 | sing | 1.09Å | 1.10Å | |
| C5' | H12 | sing | 1.09Å | 1.10Å | |
| O1A | H13 | sing | 0.97Å | 0.95Å | |
| O1B | H14 | sing | 0.97Å | 0.95Å | |
| C3B | H15 | sing | 1.09Å | 1.10Å | |
| O1G | H16 | sing | 0.97Å | 0.95Å | |
| O2G | H17 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2 | C2 | N3 | 119.1° | 119.5° |
| O2 | C2 | N1 | 119.0° | 119.4° |
| N3 | C2 | N1 | 121.9° | 121.1° |
| C2 | N3 | C4 | 119.5° | 120.7° |
| C2 | N1 | C1' | 119.5° | 119.8° |
| C2 | N1 | C6 | 121.4° | 120.3° |
| C1' | C2' | C3' | 105.3° | 104.1° |
| C2' | C1' | N1 | 108.6° | 110.4° |
| C2' | C1' | O4' | 106.6° | 104.8° |
| C2' | C1' | H5 | 114.0° | 110.5° |
| C1' | C2' | H6 | 110.5° | 110.6° |
| C1' | C2' | H7 | 110.5° | 110.5° |
| C2' | C3' | O3' | 114.1° | 110.5° |
| C2' | C3' | C4' | 99.6° | 104.1° |
| C3' | C2' | H6 | 110.5° | 110.5° |
| C3' | C2' | H7 | 110.5° | 110.5° |
| C2' | C3' | H8 | 108.8° | 110.5° |
| N3 | C4 | N4 | 120.3° | 120.2° |
| N3 | C4 | C5 | 120.6° | 119.6° |
| N1 | C1' | O4' | 107.4° | 110.4° |
| C1' | N1 | C6 | 119.1° | 119.9° |
| N1 | C1' | H5 | 110.6° | 110.3° |
| C1' | O4' | C4' | 107.0° | 105.3° |
| O4' | C1' | H5 | 109.3° | 110.3° |
| N1 | C6 | C5 | 119.1° | 119.3° |
| N1 | C6 | H4 | 120.4° | 120.3° |
| O3' | C3' | C4' | 113.0° | 110.5° |
| O3' | C3' | H8 | 111.3° | 110.6° |
| C3' | O3' | H9 | 109.5° | 114.0° |
| N4 | C4 | C5 | 119.1° | 120.2° |
| C4 | N4 | H1 | 120.0° | 120.0° |
| C4 | N4 | H2 | 120.0° | 120.0° |
| C4 | C5 | C6 | 117.5° | 119.0° |
| C4 | C5 | H3 | 121.2° | 120.5° |
| C3' | C4' | O4' | 103.5° | 104.8° |
| C3' | C4' | C5' | 112.0° | 110.4° |
| C4' | C3' | H8 | 109.3° | 110.5° |
| C3' | C4' | H10 | 109.9° | 110.4° |
| O4' | C4' | C5' | 109.2° | 110.4° |
| O4' | C4' | H10 | 113.4° | 110.4° |
| C4' | C5' | O5' | 108.2° | 109.5° |
| C5' | C4' | H10 | 108.8° | 110.4° |
| C4' | C5' | H11 | 109.8° | 109.5° |
| C4' | C5' | H12 | 109.8° | 109.5° |
| C6 | C5 | H3 | 121.3° | 120.5° |
| C5 | C6 | H4 | 120.5° | 120.3° |
| O2B | PB | O3A | 103.3° | 109.5° |
| O2B | PB | O1B | 112.7° | 109.5° |
| O2B | PB | C3B | 106.9° | 109.4° |
| C5' | O5' | PA | 118.2° | 123.0° |
| O5' | C5' | H11 | 109.8° | 109.4° |
| O5' | C5' | H12 | 109.8° | 109.5° |
| O3A | PB | O1B | 112.7° | 109.5° |
| O3A | PB | C3B | 108.1° | 109.5° |
| PB | O3A | PA | 129.2° | 134.0° |
| O1B | PB | C3B | 112.6° | 109.5° |
| PB | O1B | H14 | 109.5° | 114.0° |
| PB | C3B | F4B | 105.5° | 109.4° |
| PB | C3B | PG | 110.5° | 109.5° |
| PB | C3B | H15 | 108.0° | 109.5° |
| O5' | PA | O3A | 104.3° | 109.5° |
| O5' | PA | O2A | 109.0° | 109.5° |
| O5' | PA | O1A | 109.8° | 109.5° |
| O3A | PA | O2A | 106.7° | 109.5° |
| O3A | PA | O1A | 111.8° | 109.4° |
| F4B | C3B | PG | 108.2° | 109.5° |
| F4B | C3B | H15 | 115.9° | 109.5° |
| C3B | PG | O3G | 110.6° | 109.5° |
| C3B | PG | O2G | 107.7° | 109.5° |
| C3B | PG | O1G | 108.4° | 109.5° |
| PG | C3B | H15 | 108.6° | 109.5° |
| O2A | PA | O1A | 114.6° | 109.5° |
| PA | O1A | H13 | 109.5° | 114.0° |
| O3G | PG | O2G | 109.4° | 109.5° |
| O3G | PG | O1G | 109.9° | 109.4° |
| O2G | PG | O1G | 110.8° | 109.4° |
| PG | O2G | H17 | 109.5° | 114.0° |
| PG | O1G | H16 | 109.5° | 114.0° |
| H1 | N4 | H2 | 120.0° | 120.1° |
| H6 | C2' | H7 | 109.5° | 110.6° |
| H11 | C5' | H12 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | C2 | N3 | N1 | 179.5° | 180.0° |
| O2 | C2 | N3 | C4 | 179.4° | 180.0° |
| O2 | C2 | N1 | C1' | 1.9° | 0.0° |
| O2 | C2 | N1 | C6 | 179.9° | 179.8° |
| N3 | C2 | N1 | C1' | 178.6° | 180.0° |
| N3 | C2 | N1 | C6 | 0.5° | 0.3° |
| C2 | N3 | C4 | N4 | 178.7° | 180.0° |
| C2 | N3 | C4 | C5 | 1.2° | 0.3° |
| C2 | N1 | C1' | C2' | 91.1° | 61.9° |
| N1 | C2 | N3 | C4 | 1.0° | 0.0° |
| C2 | N1 | C1' | C6 | 178.1° | 179.8° |
| C2 | N1 | C1' | O4' | 154.0° | 53.6° |
| C2 | N1 | C6 | C5 | 0.2° | 0.3° |
| C2 | N1 | C6 | H4 | 179.8° | 179.8° |
| C2 | N1 | C1' | H5 | 34.7° | 175.8° |
| C1' | C2' | C3' | H6 | 119.3° | 118.7° |
| C1' | C2' | C3' | H7 | 119.3° | 118.6° |
| C2' | C1' | N1 | O4' | 115.0° | 115.4° |
| C2' | C1' | N1 | H5 | 125.8° | 122.4° |
| C2' | C1' | O4' | H5 | 123.7° | 118.9° |
| C2' | C1' | N1 | C6 | 87.0° | 117.9° |
| C1' | C2' | C3' | O3' | 157.7° | 118.6° |
| C1' | C2' | C3' | C4' | 37.0° | 0.0° |
| C2' | C1' | O4' | C4' | 7.7° | 40.5° |
| C1' | C2' | H6 | H7 | 121.9° | 122.7° |
| C1' | C2' | C3' | H8 | 77.4° | 118.6° |
| C3' | C2' | C1' | N1 | 96.1° | 142.8° |
| C3' | C2' | C1' | O4' | 19.4° | 24.0° |
| C2' | C3' | O3' | C4' | 112.9° | 114.6° |
| C2' | C3' | O3' | H8 | 123.7° | 122.7° |
| C2' | C3' | C4' | H8 | 114.0° | 118.6° |
| C2' | C3' | C4' | O4' | 41.6° | 24.0° |
| C2' | C3' | C4' | C5' | 159.1° | 142.8° |
| C3' | C2' | C1' | H5 | 140.1° | 94.9° |
| C3' | C2' | H6 | H7 | 121.9° | 122.6° |
| C2' | C3' | O3' | H9 | 145.3° | 61.5° |
| C2' | C3' | C4' | H10 | 79.9° | 94.9° |
| N3 | C4 | N4 | C5 | 179.9° | 179.8° |
| N3 | C4 | C5 | C6 | 0.9° | 0.3° |
| N3 | C4 | N4 | H1 | 0.0° | 179.7° |
| N3 | C4 | N4 | H2 | 180.0° | 0.2° |
| N3 | C4 | C5 | H3 | 179.1° | 179.8° |
| N1 | C1' | O4' | H5 | 120.1° | 122.2° |
| N1 | C1' | O4' | C4' | 123.9° | 159.3° |
| C1' | N1 | C6 | C5 | 178.2° | 180.0° |
| C1' | N1 | C6 | H4 | 1.8° | 0.0° |
| N1 | C1' | C2' | H6 | 144.6° | 98.5° |
| N1 | C1' | C2' | H7 | 23.2° | 24.2° |
| O4' | C1' | N1 | C6 | 27.9° | 126.7° |
| C1' | O4' | C4' | C3' | 31.2° | 40.5° |
| C1' | O4' | C4' | C5' | 150.6° | 159.3° |
| O4' | C1' | C2' | H6 | 100.0° | 142.6° |
| O4' | C1' | C2' | H7 | 138.7° | 94.7° |
| C1' | O4' | C4' | H10 | 87.9° | 78.4° |
| N1 | C6 | C5 | C4 | 0.3° | 0.0° |
| N1 | C6 | C5 | H4 | 180.0° | 180.0° |
| N1 | C6 | C5 | H3 | 179.6° | 179.9° |
| C6 | N1 | C1' | H5 | 147.2° | 4.5° |
| O3' | C3' | C4' | H8 | 124.5° | 122.7° |
| O3' | C3' | C4' | O4' | 163.0° | 142.6° |
| O3' | C3' | C4' | C5' | 79.5° | 98.5° |
| O3' | C3' | C2' | H6 | 38.3° | 0.1° |
| O3' | C3' | C2' | H7 | 83.0° | 122.7° |
| O3' | C3' | C4' | H10 | 41.6° | 23.8° |
| N4 | C4 | C5 | C6 | 179.1° | 179.9° |
| C4 | N4 | H1 | H2 | 180.0° | 179.9° |
| N4 | C4 | C5 | H3 | 1.0° | 0.0° |
| C4 | C5 | C6 | H3 | 180.0° | 179.9° |
| C5 | C4 | N4 | H1 | 179.9° | 0.1° |
| C5 | C4 | N4 | H2 | 0.1° | 180.0° |
| C4 | C5 | C6 | H4 | 179.7° | 179.9° |
| C3' | C4' | O4' | C5' | 119.4° | 118.8° |
| C3' | C4' | O4' | H10 | 119.1° | 118.8° |
| C3' | C4' | C5' | H10 | 121.7° | 122.3° |
| C3' | C4' | C5' | O5' | 60.3° | 175.0° |
| C4' | C3' | C2' | H6 | 82.4° | 118.7° |
| C4' | C3' | C2' | H7 | 156.3° | 118.6° |
| C4' | C3' | O3' | H9 | 101.8° | 176.1° |
| C3' | C4' | C5' | H11 | 179.8° | 55.0° |
| C3' | C4' | C5' | H12 | 59.5° | 65.0° |
| O4' | C4' | C5' | H10 | 124.3° | 122.3° |
| O4' | C4' | C5' | O5' | 53.7° | 69.6° |
| C4' | O4' | C1' | H5 | 116.0° | 78.4° |
| O4' | C4' | C3' | H8 | 72.4° | 94.7° |
| O4' | C4' | C5' | H11 | 66.1° | 170.4° |
| O4' | C4' | C5' | H12 | 173.5° | 50.4° |
| C4' | C5' | O5' | H11 | 119.8° | 120.0° |
| C4' | C5' | O5' | H12 | 119.8° | 120.1° |
| C4' | C5' | O5' | PA | 132.8° | 180.0° |
| C5' | C4' | C3' | H8 | 45.1° | 24.2° |
| C4' | C5' | H11 | H12 | 120.6° | 120.0° |
| O2B | PB | O3A | O1B | 121.9° | 120.0° |
| O2B | PB | O3A | C3B | 113.0° | 120.0° |
| O2B | PB | O1B | C3B | 121.0° | 120.0° |
| O2B | PB | O3A | PA | 144.3° | 60.1° |
| O2B | PB | C3B | F4B | 94.1° | 180.0° |
| O2B | PB | C3B | PG | 149.1° | 60.0° |
| O2B | PB | O1B | H14 | 0.0° | 180.0° |
| O2B | PB | C3B | H15 | 30.4° | 60.0° |
| C5' | O5' | PA | O3A | 66.4° | 175.0° |
| C5' | O5' | PA | O2A | 179.9° | 55.0° |
| C5' | O5' | PA | O1A | 53.6° | 65.0° |
| O5' | C5' | C4' | H10 | 178.0° | 52.7° |
| O5' | C5' | H11 | H12 | 120.6° | 119.9° |
| O3A | PB | O1B | C3B | 122.6° | 120.0° |
| PB | O3A | PA | O5' | 110.8° | 165.0° |
| O3A | PB | C3B | F4B | 16.5° | 60.0° |
| O3A | PB | C3B | PG | 100.3° | 180.0° |
| PB | O3A | PA | O2A | 133.9° | 44.9° |
| PB | O3A | PA | O1A | 7.8° | 75.0° |
| O3A | PB | O1B | H14 | 116.4° | 60.0° |
| O3A | PB | C3B | H15 | 141.0° | 60.0° |
| O1B | PB | O3A | PA | 22.4° | 59.9° |
| O1B | PB | C3B | F4B | 141.6° | 60.1° |
| O1B | PB | C3B | PG | 24.8° | 60.0° |
| O1B | PB | C3B | H15 | 93.9° | 180.0° |
| C3B | PB | O3A | PA | 102.7° | 180.0° |
| PB | C3B | F4B | PG | 118.3° | 120.0° |
| PB | C3B | F4B | H15 | 119.5° | 120.0° |
| PB | C3B | PG | H15 | 118.3° | 120.0° |
| PB | C3B | PG | O3G | 87.9° | 60.0° |
| PB | C3B | PG | O2G | 31.6° | 60.0° |
| PB | C3B | PG | O1G | 151.5° | 180.0° |
| C3B | PB | O1B | H14 | 121.0° | 60.0° |
| O5' | PA | O3A | O2A | 115.3° | 120.0° |
| O5' | PA | O3A | O1A | 118.7° | 120.0° |
| O5' | PA | O2A | O1A | 123.5° | 120.0° |
| PA | O5' | C5' | H11 | 107.4° | 60.0° |
| PA | O5' | C5' | H12 | 13.0° | 59.9° |
| O5' | PA | O1A | H13 | 123.0° | 60.0° |
| O3A | PA | O2A | O1A | 124.4° | 119.9° |
| O3A | PA | O1A | H13 | 121.7° | 60.0° |
| F4B | C3B | PG | H15 | 126.6° | 120.0° |
| F4B | C3B | PG | O3G | 157.0° | 180.0° |
| F4B | C3B | PG | O2G | 83.5° | 60.0° |
| F4B | C3B | PG | O1G | 36.4° | 60.0° |
| C3B | PG | O3G | O2G | 118.5° | 120.0° |
| C3B | PG | O3G | O1G | 119.7° | 120.0° |
| C3B | PG | O2G | O1G | 118.4° | 120.0° |
| C3B | PG | O1G | H16 | 121.0° | 180.0° |
| C3B | PG | O2G | H17 | 120.2° | 60.0° |
| O2A | PA | O1A | H13 | 0.0° | 180.0° |
| O3G | PG | O2G | O1G | 121.3° | 120.0° |
| O3G | PG | C3B | H15 | 30.4° | 60.0° |
| O3G | PG | O1G | H16 | 0.0° | 60.0° |
| O3G | PG | O2G | H17 | 0.0° | 179.9° |
| O2G | PG | C3B | H15 | 149.9° | 180.0° |
| O2G | PG | O1G | H16 | 121.0° | 60.0° |
| O1G | PG | C3B | H15 | 90.2° | 60.0° |
| O1G | PG | O2G | H17 | 121.4° | 60.0° |
| H3 | C5 | C6 | H4 | 0.4° | 0.0° |
| H5 | C1' | C2' | H6 | 20.8° | 23.7° |
| H5 | C1' | C2' | H7 | 100.5° | 146.5° |
| H6 | C2' | C3' | H8 | 163.3° | 122.7° |
| H7 | C2' | C3' | H8 | 42.0° | 0.0° |
| H8 | C3' | O3' | H9 | 21.7° | 61.2° |
| H8 | C3' | C4' | H10 | 166.2° | 146.5° |
| H10 | C4' | C5' | H11 | 58.1° | 67.3° |
| H10 | C4' | C5' | H12 | 62.3° | 172.7° |
