FFD
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O1P | P | doub | 1.48Å | 1.49Å | |
P | O3P | sing | 1.61Å | 1.59Å | |
P | O2P | sing | 1.61Å | 1.48Å | |
P | O5' | sing | 1.61Å | 1.59Å | |
F | C1 | sing | 1.35Å | 1.35Å | |
O5' | C5' | sing | 1.43Å | 1.41Å | |
C1 | C | doub | 1.38Å | 1.39Å | Aromatic |
C1 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
C | C6 | sing | 1.38Å | 1.38Å | Aromatic |
C3 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
C5' | C4' | sing | 1.53Å | 1.52Å | |
O4' | C4' | sing | 1.44Å | 1.43Å | |
O4' | C1' | sing | 1.44Å | 1.37Å | |
C6 | C1' | sing | 1.51Å | 1.51Å | |
C6 | C5 | doub | 1.38Å | 1.39Å | Aromatic |
C3' | C4' | sing | 1.55Å | 1.53Å | |
C3' | C2' | sing | 1.55Å | 1.51Å | |
C3' | O3' | sing | 1.43Å | 1.42Å | |
C4 | C5 | sing | 1.38Å | 1.39Å | Aromatic |
C2' | C1' | sing | 1.54Å | 1.53Å | |
O3P | HOP3 | sing | 0.97Å | 0.95Å | |
C | H | sing | 1.08Å | 1.08Å | |
C3 | H3 | sing | 1.08Å | 1.08Å | |
C4 | H4 | sing | 1.08Å | 1.08Å | |
C5 | H5 | sing | 1.08Å | 1.08Å | |
C1' | H1' | sing | 1.09Å | 1.10Å | |
C2' | H2'1 | sing | 1.09Å | 1.10Å | |
C2' | H2'2 | sing | 1.09Å | 1.10Å | |
C3' | H3' | sing | 1.09Å | 1.10Å | |
O3' | H3T | sing | 0.97Å | 0.95Å | |
C4' | H4' | sing | 1.09Å | 1.10Å | |
C5' | H5'1 | sing | 1.09Å | 1.10Å | |
C5' | H5'2 | sing | 1.09Å | 1.10Å | |
O2P | HOP2 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O1P | P | O3P | 108.0° | 109.5° |
O1P | P | O2P | 120.4° | 109.5° |
O1P | P | O5' | 107.1° | 109.4° |
O3P | P | O2P | 108.0° | 109.5° |
O3P | P | O5' | 102.7° | 109.5° |
P | O3P | HOP3 | 109.5° | 114.0° |
O2P | P | O5' | 109.3° | 109.5° |
P | O2P | HOP2 | 109.5° | 114.0° |
P | O5' | C5' | 119.8° | 123.0° |
F | C1 | C | 119.9° | 120.0° |
F | C1 | C3 | 119.9° | 120.0° |
O5' | C5' | C4' | 109.8° | 109.5° |
O5' | C5' | H5'1 | 109.4° | 109.5° |
O5' | C5' | H5'2 | 109.3° | 109.5° |
C | C1 | C3 | 120.2° | 120.0° |
C1 | C | C6 | 119.7° | 120.0° |
C1 | C | H | 120.1° | 120.0° |
C1 | C3 | C4 | 120.1° | 120.0° |
C1 | C3 | H3 | 119.9° | 120.1° |
C | C6 | C1' | 119.6° | 120.0° |
C | C6 | C5 | 120.4° | 120.0° |
C6 | C | H | 120.2° | 120.0° |
C3 | C4 | C5 | 119.7° | 120.0° |
C4 | C3 | H3 | 119.9° | 120.0° |
C3 | C4 | H4 | 120.1° | 120.0° |
C5' | C4' | O4' | 109.6° | 110.4° |
C5' | C4' | C3' | 115.0° | 110.4° |
C5' | C4' | H4' | 104.2° | 110.4° |
C4' | C5' | H5'1 | 109.3° | 109.4° |
C4' | C5' | H5'2 | 109.3° | 109.4° |
C4' | O4' | C1' | 106.5° | 105.3° |
O4' | C4' | C3' | 104.7° | 104.8° |
O4' | C4' | H4' | 114.6° | 110.4° |
O4' | C1' | C6 | 107.5° | 110.4° |
O4' | C1' | C2' | 105.3° | 104.9° |
O4' | C1' | H1' | 114.6° | 110.4° |
C1' | C6 | C5 | 120.0° | 120.0° |
C6 | C1' | C2' | 112.7° | 110.4° |
C6 | C1' | H1' | 107.3° | 110.3° |
C6 | C5 | C4 | 119.9° | 120.0° |
C6 | C5 | H5 | 120.1° | 120.0° |
C4' | C3' | C2' | 103.8° | 104.0° |
C4' | C3' | O3' | 109.2° | 110.5° |
C4' | C3' | H3' | 114.1° | 110.5° |
C3' | C4' | H4' | 109.1° | 110.3° |
C2' | C3' | O3' | 111.8° | 110.6° |
C3' | C2' | C1' | 103.7° | 104.1° |
C3' | C2' | H2'1 | 111.4° | 110.5° |
C3' | C2' | H2'2 | 112.6° | 110.7° |
C2' | C3' | H3' | 111.6° | 110.5° |
O3' | C3' | H3' | 106.4° | 110.6° |
C3' | O3' | H3T | 109.5° | 114.0° |
C5 | C4 | H4 | 120.1° | 120.0° |
C4 | C5 | H5 | 120.1° | 120.0° |
C2' | C1' | H1' | 109.6° | 110.3° |
C1' | C2' | H2'1 | 111.4° | 110.5° |
C1' | C2' | H2'2 | 112.7° | 110.5° |
H2'1 | C2' | H2'2 | 105.1° | 110.4° |
H5'1 | C5' | H5'2 | 109.8° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O1P | P | O3P | O2P | 131.6° | 120.0° |
O1P | P | O3P | O5' | 112.9° | 120.0° |
O1P | P | O2P | O5' | 124.4° | 120.0° |
O1P | P | O5' | C5' | 176.1° | 55.0° |
O1P | P | O3P | HOP3 | 37.1° | 179.9° |
O1P | P | O2P | HOP2 | 154.2° | 60.0° |
O3P | P | O2P | O5' | 111.0° | 120.0° |
O3P | P | O5' | C5' | 70.3° | 64.9° |
O3P | P | O2P | HOP2 | 81.3° | 60.0° |
O2P | P | O5' | C5' | 44.2° | 175.0° |
O2P | P | O3P | HOP3 | 94.5° | 59.9° |
P | O5' | C5' | C4' | 167.6° | 180.0° |
O5' | P | O3P | HOP3 | 150.1° | 60.1° |
P | O5' | C5' | H5'1 | 72.4° | 60.0° |
P | O5' | C5' | H5'2 | 47.8° | 60.1° |
O5' | P | O2P | HOP2 | 29.8° | 179.9° |
F | C1 | C | C3 | 180.0° | 179.9° |
F | C1 | C | C6 | 179.9° | 179.9° |
F | C1 | C3 | C4 | 180.0° | 180.0° |
F | C1 | C | H | 0.1° | 0.3° |
F | C1 | C3 | H3 | 0.0° | 0.0° |
O5' | C5' | C4' | H5'1 | 120.0° | 120.0° |
O5' | C5' | C4' | H5'2 | 119.8° | 120.0° |
O5' | C5' | C4' | O4' | 56.9° | 66.4° |
O5' | C5' | C4' | C3' | 60.6° | 178.1° |
O5' | C5' | C4' | H4' | 180.0° | 55.8° |
O5' | C5' | H5'1 | H5'2 | 119.9° | 120.0° |
C1 | C | C6 | H | 180.0° | 179.7° |
C | C1 | C3 | C4 | 0.0° | 0.0° |
C1 | C | C6 | C1' | 179.7° | 179.7° |
C1 | C | C6 | C5 | 0.1° | 0.0° |
C | C1 | C3 | H3 | 180.0° | 179.9° |
C3 | C1 | C | C6 | 0.1° | 0.0° |
C1 | C3 | C4 | H3 | 180.0° | 180.0° |
C1 | C3 | C4 | C5 | 0.3° | 0.1° |
C3 | C1 | C | H | 179.9° | 179.7° |
C1 | C3 | C4 | H4 | 179.7° | 180.0° |
C | C6 | C1' | O4' | 46.1° | 142.9° |
C | C6 | C1' | C5 | 179.6° | 179.7° |
C | C6 | C5 | C4 | 0.5° | 0.0° |
C | C6 | C1' | C2' | 69.5° | 101.6° |
C | C6 | C5 | H5 | 179.5° | 180.0° |
C | C6 | C1' | H1' | 169.8° | 20.6° |
C3 | C4 | C5 | C6 | 0.5° | 0.0° |
C3 | C4 | C5 | H4 | 180.0° | 180.0° |
C3 | C4 | C5 | H5 | 179.4° | 180.0° |
C5' | C4' | O4' | C3' | 123.8° | 118.9° |
C5' | C4' | O4' | H4' | 116.7° | 122.3° |
C5' | C4' | O4' | C1' | 161.8° | 159.3° |
C5' | C4' | C3' | H4' | 116.6° | 122.3° |
C5' | C4' | C3' | C2' | 139.4° | 142.8° |
C5' | C4' | C3' | O3' | 101.1° | 98.5° |
C5' | C4' | C3' | H3' | 17.8° | 24.2° |
C4' | C5' | H5'1 | H5'2 | 119.8° | 120.0° |
C4' | O4' | C1' | C6 | 161.3° | 159.3° |
O4' | C4' | C3' | H4' | 123.1° | 118.8° |
O4' | C4' | C3' | C2' | 19.2° | 23.9° |
O4' | C4' | C3' | O3' | 138.6° | 142.6° |
C4' | O4' | C1' | C2' | 40.9° | 40.4° |
C4' | O4' | C1' | H1' | 79.5° | 78.4° |
O4' | C4' | C3' | H3' | 102.5° | 94.6° |
O4' | C4' | C5' | H5'1 | 176.9° | 173.5° |
O4' | C4' | C5' | H5'2 | 62.9° | 53.5° |
O4' | C1' | C6 | C2' | 115.5° | 115.5° |
O4' | C1' | C6 | H1' | 123.7° | 122.3° |
O4' | C1' | C6 | C5 | 134.3° | 36.8° |
C1' | O4' | C4' | C3' | 38.0° | 40.4° |
O4' | C1' | C2' | C3' | 27.0° | 23.9° |
O4' | C1' | C2' | H1' | 123.7° | 118.9° |
O4' | C1' | C2' | H2'1 | 93.0° | 142.6° |
O4' | C1' | C2' | H2'2 | 149.1° | 94.9° |
C1' | O4' | C4' | H4' | 81.5° | 78.4° |
C6 | C1' | C2' | C3' | 143.9° | 142.8° |
C1' | C6 | C5 | C4 | 179.9° | 179.6° |
C6 | C1' | C2' | H1' | 119.5° | 122.2° |
C1' | C6 | C | H | 0.3° | 0.1° |
C1' | C6 | C5 | H5 | 0.1° | 0.3° |
C6 | C1' | C2' | H2'1 | 23.9° | 98.5° |
C6 | C1' | C2' | H2'2 | 94.0° | 24.0° |
C6 | C5 | C4 | H5 | 180.0° | 180.0° |
C5 | C6 | C1' | C2' | 110.1° | 78.7° |
C5 | C6 | C | H | 179.9° | 179.7° |
C6 | C5 | C4 | H4 | 179.5° | 180.0° |
C5 | C6 | C1' | H1' | 10.6° | 159.0° |
C4' | C3' | C2' | O3' | 117.6° | 118.7° |
C4' | C3' | C2' | H3' | 123.3° | 118.6° |
C4' | C3' | O3' | H3' | 123.6° | 122.7° |
C4' | C3' | C2' | C1' | 4.0° | 0.0° |
C4' | C3' | C2' | H2'1 | 116.0° | 118.7° |
C4' | C3' | C2' | H2'2 | 126.1° | 118.8° |
C4' | C3' | O3' | H3T | 76.2° | 180.0° |
C3' | C4' | C5' | H5'1 | 59.4° | 58.1° |
C3' | C4' | C5' | H5'2 | 179.5° | 61.9° |
C2' | C3' | O3' | H3' | 122.1° | 122.7° |
C3' | C2' | C1' | H2'1 | 120.0° | 118.6° |
C3' | C2' | C1' | H2'2 | 122.1° | 118.8° |
C3' | C2' | C1' | H1' | 96.7° | 95.0° |
C3' | C2' | H2'1 | H2'2 | 122.3° | 122.7° |
C2' | C3' | O3' | H3T | 38.1° | 65.4° |
C2' | C3' | C4' | H4' | 103.9° | 94.9° |
O3' | C3' | C2' | C1' | 113.7° | 118.7° |
O3' | C3' | C2' | H2'1 | 126.3° | 0.0° |
O3' | C3' | C2' | H2'2 | 8.5° | 122.6° |
O3' | C3' | C4' | H4' | 15.5° | 23.8° |
C5 | C4 | C3 | H3 | 179.7° | 179.9° |
C1' | C2' | H2'1 | H2'2 | 122.4° | 122.6° |
C1' | C2' | C3' | H3' | 127.3° | 118.6° |
H3 | C3 | C4 | H4 | 0.3° | 0.0° |
H4 | C4 | C5 | H5 | 0.5° | 0.0° |
H1' | C1' | C2' | H2'1 | 143.3° | 23.7° |
H1' | C1' | C2' | H2'2 | 25.4° | 146.2° |
H2'1 | C2' | C3' | H3' | 7.3° | 122.7° |
H2'2 | C2' | C3' | H3' | 110.6° | 0.2° |
H3' | C3' | O3' | H3T | 160.2° | 57.3° |
H3' | C3' | C4' | H4' | 134.4° | 146.6° |
H4' | C4' | C5' | H5'1 | 60.0° | 64.2° |
H4' | C4' | C5' | H5'2 | 60.1° | 175.8° |