AVC
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
OP3 | P | sing | 1.61Å | 94.38Å | |
OP3 | HOP3 | sing | 0.97Å | 0.95Å | |
P | OP1 | doub | 1.48Å | 1.49Å | |
P | OP2 | sing | 1.61Å | 1.49Å | |
P | O5' | sing | 1.61Å | 1.59Å | |
OP2 | HOP2 | sing | 0.97Å | 0.95Å | |
O5' | C5' | sing | 1.43Å | 1.41Å | |
C5' | C4' | sing | 1.53Å | 1.50Å | |
C5' | H5' | sing | 1.09Å | 1.10Å | |
C5' | H5'' | sing | 1.09Å | 1.10Å | |
C4' | O4' | sing | 1.45Å | 1.44Å | |
C4' | C3' | sing | 1.55Å | 1.52Å | |
C4' | H4' | sing | 1.09Å | 1.10Å | |
O4' | C1' | sing | 1.44Å | 1.41Å | |
C3' | O3' | sing | 1.44Å | 1.38Å | |
C3' | C2' | sing | 1.54Å | 1.53Å | |
C3' | H3' | sing | 1.09Å | 1.10Å | |
O3' | V | sing | 1.87Å | 1.96Å | |
C2' | O2' | sing | 1.46Å | 1.38Å | |
C2' | C1' | sing | 1.55Å | 1.53Å | |
C2' | H2' | sing | 1.09Å | 1.10Å | |
O2' | V | sing | 1.87Å | 1.96Å | |
C1' | N9 | sing | 1.47Å | 1.46Å | |
C1' | H1' | sing | 1.09Å | 1.10Å | |
V | O1V | doub | 1.58Å | 1.64Å | |
V | O2V | sing | 1.84Å | 1.63Å | |
O2V | HV | sing | 0.97Å | 0.95Å | |
N9 | C8 | sing | 1.36Å | 1.37Å | Aromatic |
N9 | C4 | sing | 1.37Å | 1.38Å | Aromatic |
C8 | N7 | doub | 1.30Å | 1.31Å | Aromatic |
C8 | H8 | sing | 1.08Å | 1.08Å | |
N7 | C5 | sing | 1.35Å | 1.39Å | Aromatic |
C5 | C6 | sing | 1.41Å | 1.41Å | Aromatic |
C5 | C4 | doub | 1.41Å | 1.38Å | Aromatic |
C6 | N6 | sing | 1.38Å | 1.34Å | |
C6 | N1 | doub | 1.33Å | 1.35Å | Aromatic |
N6 | H61 | sing | 0.97Å | 1.00Å | |
N6 | H62 | sing | 0.97Å | 1.00Å | |
N1 | C2 | sing | 1.32Å | 1.34Å | Aromatic |
C2 | N3 | doub | 1.32Å | 1.33Å | Aromatic |
C2 | H2 | sing | 1.08Å | 1.08Å | |
N3 | C4 | sing | 1.33Å | 1.34Å | Aromatic |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
P | OP3 | HOP3 | 81.8° | 114.0° |
OP3 | P | OP1 | 81.7° | 109.5° |
OP3 | P | OP2 | 65.8° | 109.5° |
OP3 | P | O5' | 72.1° | 109.5° |
OP1 | P | OP2 | 119.7° | 109.5° |
OP1 | P | O5' | 107.6° | 109.4° |
OP2 | P | O5' | 108.3° | 109.5° |
P | OP2 | HOP2 | 109.5° | 114.0° |
P | O5' | C5' | 120.4° | 123.0° |
O5' | C5' | C4' | 109.8° | 109.4° |
O5' | C5' | H5' | 109.3° | 109.4° |
O5' | C5' | H5'' | 109.3° | 109.5° |
C4' | C5' | H5' | 109.4° | 109.5° |
C4' | C5' | H5'' | 109.3° | 109.5° |
C5' | C4' | O4' | 108.2° | 110.7° |
C5' | C4' | C3' | 115.8° | 110.7° |
C5' | C4' | H4' | 105.1° | 110.6° |
H5' | C5' | H5'' | 109.7° | 109.5° |
O4' | C4' | C3' | 106.5° | 103.1° |
O4' | C4' | H4' | 114.6° | 110.7° |
C4' | O4' | C1' | 109.0° | 107.1° |
C3' | C4' | H4' | 106.9° | 110.9° |
C4' | C3' | O3' | 110.9° | 110.2° |
C4' | C3' | C2' | 105.5° | 102.7° |
C4' | C3' | H3' | 111.7° | 109.0° |
O4' | C1' | C2' | 107.6° | 107.3° |
O4' | C1' | N9 | 108.7° | 109.9° |
O4' | C1' | H1' | 111.4° | 109.9° |
O3' | C3' | C2' | 111.1° | 116.8° |
O3' | C3' | H3' | 106.2° | 109.2° |
C3' | O3' | V | 117.9° | 101.5° |
C2' | C3' | H3' | 111.5° | 108.6° |
C3' | C2' | O2' | 111.2° | 112.7° |
C3' | C2' | C1' | 104.4° | 103.8° |
C3' | C2' | H2' | 112.0° | 110.9° |
O3' | V | O2' | 80.3° | 97.8° |
O3' | V | O1V | 128.3° | 111.8° |
O3' | V | O2V | 121.9° | 111.7° |
O2' | C2' | C1' | 110.6° | 106.6° |
O2' | C2' | H2' | 106.0° | 110.9° |
C2' | O2' | V | 118.0° | 98.8° |
C1' | C2' | H2' | 112.7° | 111.8° |
C2' | C1' | N9 | 110.0° | 109.9° |
C2' | C1' | H1' | 110.1° | 109.8° |
O2' | V | O1V | 100.5° | 111.7° |
O2' | V | O2V | 97.6° | 111.7° |
N9 | C1' | H1' | 109.1° | 110.1° |
C1' | N9 | C8 | 128.6° | 126.3° |
C1' | N9 | C4 | 125.5° | 126.2° |
O1V | V | O2V | 109.4° | 111.5° |
V | O2V | HV | 109.5° | 114.0° |
C8 | N9 | C4 | 105.9° | 107.5° |
N9 | C8 | N7 | 113.6° | 110.0° |
N9 | C8 | H8 | 123.2° | 125.0° |
N9 | C4 | C5 | 105.8° | 105.9° |
N9 | C4 | N3 | 127.3° | 135.0° |
N7 | C8 | H8 | 123.2° | 125.0° |
C8 | N7 | C5 | 104.0° | 109.4° |
N7 | C5 | C6 | 132.5° | 134.7° |
N7 | C5 | C4 | 110.6° | 107.1° |
C6 | C5 | C4 | 116.9° | 118.1° |
C5 | C6 | N6 | 123.8° | 120.7° |
C5 | C6 | N1 | 117.8° | 118.4° |
C5 | C4 | N3 | 126.8° | 119.1° |
N6 | C6 | N1 | 118.5° | 120.8° |
C6 | N6 | H61 | 109.5° | 120.1° |
C6 | N6 | H62 | 109.5° | 120.0° |
C6 | N1 | C2 | 118.5° | 121.2° |
H61 | N6 | H62 | 109.5° | 120.0° |
N1 | C2 | N3 | 129.3° | 122.4° |
N1 | C2 | H2 | 115.3° | 118.7° |
N3 | C2 | H2 | 115.4° | 118.9° |
C2 | N3 | C4 | 110.7° | 120.7° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
OP3 | P | OP1 | OP2 | 56.0° | 120.0° |
OP3 | P | OP1 | O5' | 68.2° | 120.0° |
OP3 | P | OP2 | O5' | 59.8° | 120.0° |
OP3 | P | OP2 | HOP2 | 72.6° | 60.0° |
OP3 | P | O5' | C5' | 28.0° | 65.0° |
HOP3 | OP3 | P | OP1 | 180.0° | 180.0° |
HOP3 | OP3 | P | OP2 | 52.1° | 60.0° |
HOP3 | OP3 | P | O5' | 68.4° | 60.0° |
OP1 | P | OP2 | O5' | 123.8° | 120.0° |
OP1 | P | OP2 | HOP2 | 8.6° | 60.0° |
OP1 | P | O5' | C5' | 46.9° | 55.0° |
OP2 | P | O5' | C5' | 83.9° | 175.0° |
O5' | P | OP2 | HOP2 | 132.4° | 180.0° |
P | O5' | C5' | C4' | 138.6° | 180.0° |
P | O5' | C5' | H5' | 18.6° | 60.0° |
P | O5' | C5' | H5'' | 101.5° | 60.0° |
O5' | C5' | C4' | H5' | 120.0° | 119.9° |
O5' | C5' | C4' | H5'' | 119.9° | 120.0° |
O5' | C5' | H5' | H5'' | 119.8° | 120.0° |
O5' | C5' | C4' | O4' | 47.1° | 66.5° |
O5' | C5' | C4' | C3' | 166.5° | 179.9° |
O5' | C5' | C4' | H4' | 75.8° | 56.6° |
C4' | C5' | H5' | H5'' | 119.8° | 120.0° |
C5' | C4' | O4' | C3' | 125.1° | 118.4° |
C5' | C4' | O4' | H4' | 116.9° | 123.0° |
C5' | C4' | C3' | H4' | 116.7° | 123.1° |
C5' | C4' | O4' | C1' | 151.7° | 158.0° |
C5' | C4' | C3' | O3' | 103.3° | 78.7° |
C5' | C4' | C3' | C2' | 136.4° | 156.1° |
C5' | C4' | C3' | H3' | 15.0° | 41.1° |
H5' | C5' | C4' | O4' | 72.9° | 53.5° |
H5' | C5' | C4' | C3' | 46.5° | 60.2° |
H5' | C5' | C4' | H4' | 164.2° | 176.6° |
H5'' | C5' | C4' | O4' | 167.0° | 173.5° |
H5'' | C5' | C4' | C3' | 73.6° | 59.8° |
H5'' | C5' | C4' | H4' | 44.1° | 63.4° |
O4' | C4' | C3' | H4' | 122.9° | 118.5° |
O4' | C4' | C3' | O3' | 136.4° | 162.9° |
O4' | C4' | C3' | C2' | 16.0° | 37.7° |
O4' | C4' | C3' | H3' | 105.4° | 77.3° |
C4' | O4' | C1' | C2' | 26.2° | 25.5° |
C4' | O4' | C1' | N9 | 145.3° | 144.9° |
C4' | O4' | C1' | H1' | 94.5° | 93.9° |
C3' | C4' | O4' | C1' | 26.6° | 39.6° |
C4' | C3' | O3' | C2' | 117.0° | 116.7° |
C4' | C3' | O3' | H3' | 121.5° | 119.7° |
C4' | C3' | C2' | H3' | 121.5° | 115.3° |
C4' | C3' | O3' | V | 106.4° | 114.2° |
C4' | C3' | C2' | O2' | 118.4° | 92.8° |
C4' | C3' | C2' | C1' | 0.9° | 22.1° |
C4' | C3' | C2' | H2' | 123.1° | 142.3° |
H4' | C4' | O4' | C1' | 91.4° | 79.0° |
H4' | C4' | C3' | O3' | 13.4° | 44.4° |
H4' | C4' | C3' | C2' | 106.9° | 80.8° |
H4' | C4' | C3' | H3' | 131.7° | 164.2° |
O4' | C1' | C2' | C3' | 15.0° | 0.7° |
O4' | C1' | C2' | O2' | 134.7° | 119.9° |
O4' | C1' | C2' | N9 | 118.3° | 119.4° |
O4' | C1' | C2' | H1' | 121.5° | 119.4° |
O4' | C1' | C2' | H2' | 106.8° | 118.8° |
O4' | C1' | N9 | H1' | 121.6° | 121.1° |
O4' | C1' | N9 | C8 | 20.3° | 23.5° |
O4' | C1' | N9 | C4 | 161.7° | 156.8° |
O3' | C3' | C2' | H3' | 118.3° | 124.0° |
O3' | C3' | C2' | O2' | 1.9° | 28.0° |
O3' | C3' | C2' | C1' | 121.2° | 142.9° |
O3' | C3' | C2' | H2' | 116.6° | 97.0° |
C3' | O3' | V | O2' | 11.7° | 16.5° |
C3' | O3' | V | O1V | 84.1° | 133.6° |
C3' | O3' | V | O2V | 104.6° | 100.7° |
C2' | C3' | O3' | V | 10.6° | 2.5° |
C3' | C2' | O2' | C1' | 115.5° | 113.2° |
C3' | C2' | O2' | H2' | 122.0° | 124.9° |
C3' | C2' | C1' | H2' | 121.8° | 119.6° |
C3' | C2' | O2' | V | 7.5° | 35.4° |
C3' | C2' | C1' | N9 | 133.2° | 120.1° |
C3' | C2' | C1' | H1' | 106.5° | 118.7° |
H3' | C3' | O3' | V | 132.0° | 126.1° |
H3' | C3' | C2' | O2' | 120.2° | 151.9° |
H3' | C3' | C2' | C1' | 120.6° | 93.2° |
H3' | C3' | C2' | H2' | 1.7° | 27.0° |
O3' | V | O2' | C2' | 10.4° | 30.2° |
O3' | V | O2' | O1V | 127.4° | 117.2° |
O3' | V | O2' | O2V | 121.2° | 117.1° |
O3' | V | O1V | O2V | 172.2° | 125.8° |
O3' | V | O2V | HV | 62.4° | 180.0° |
O2' | C2' | C1' | H2' | 118.5° | 121.3° |
O2' | C2' | C1' | N9 | 107.0° | 120.7° |
O2' | C2' | C1' | H1' | 13.2° | 0.5° |
C2' | O2' | V | O1V | 116.9° | 147.4° |
C2' | O2' | V | O2V | 131.6° | 86.9° |
C1' | C2' | O2' | V | 108.0° | 148.6° |
C2' | C1' | N9 | H1' | 120.8° | 121.1° |
C2' | C1' | N9 | C8 | 97.3° | 94.3° |
C2' | C1' | N9 | C4 | 80.7° | 85.4° |
H2' | C2' | O2' | V | 129.5° | 89.5° |
H2' | C2' | C1' | N9 | 11.4° | 0.6° |
H2' | C2' | C1' | H1' | 131.6° | 121.8° |
O2' | V | O1V | O2V | 102.0° | 125.8° |
O2' | V | O2V | HV | 145.6° | 71.7° |
C1' | N9 | C8 | C4 | 178.3° | 179.7° |
C1' | N9 | C8 | N7 | 177.3° | 180.0° |
C1' | N9 | C8 | H8 | 2.7° | 0.0° |
C1' | N9 | C4 | C5 | 177.4° | 179.9° |
C1' | N9 | C4 | N3 | 1.9° | 0.8° |
H1' | C1' | N9 | C8 | 141.9° | 144.7° |
H1' | C1' | N9 | C4 | 40.1° | 35.6° |
O1V | V | O2V | HV | 110.4° | 54.1° |
N9 | C8 | N7 | H8 | 180.0° | 180.0° |
N9 | C8 | N7 | C5 | 0.6° | 0.0° |
C8 | N9 | C4 | C5 | 1.0° | 0.4° |
C8 | N9 | C4 | N3 | 179.7° | 179.5° |
C4 | N9 | C8 | N7 | 1.0° | 0.3° |
C4 | N9 | C8 | H8 | 179.0° | 179.8° |
N9 | C4 | C5 | N7 | 0.7° | 0.4° |
N9 | C4 | C5 | C6 | 179.2° | 179.8° |
N9 | C4 | C5 | N3 | 179.3° | 179.3° |
N9 | C4 | N3 | C2 | 179.1° | 179.6° |
C8 | N7 | C5 | C6 | 179.8° | 180.0° |
C8 | N7 | C5 | C4 | 0.1° | 0.2° |
H8 | C8 | N7 | C5 | 179.4° | 180.0° |
N7 | C5 | C6 | C4 | 179.9° | 179.8° |
N7 | C5 | C6 | N6 | 0.2° | 0.0° |
N7 | C5 | C6 | N1 | 179.9° | 180.0° |
N7 | C5 | C4 | N3 | 180.0° | 179.6° |
C5 | C6 | N6 | N1 | 179.9° | 180.0° |
C5 | C6 | N6 | H61 | 163.2° | 0.0° |
C5 | C6 | N6 | H62 | 43.1° | 180.0° |
C5 | C6 | N1 | C2 | 0.1° | 0.1° |
C6 | C5 | C4 | N3 | 0.1° | 0.5° |
C4 | C5 | C6 | N6 | 179.9° | 179.7° |
C4 | C5 | C6 | N1 | 0.0° | 0.2° |
C5 | C4 | N3 | C2 | 0.1° | 0.6° |
C6 | N6 | H61 | H62 | 120.0° | 179.9° |
N6 | C6 | N1 | C2 | 179.8° | 180.0° |
N1 | C6 | N6 | H61 | 16.8° | 179.9° |
N1 | C6 | N6 | H62 | 136.8° | 0.0° |
C6 | N1 | C2 | N3 | 0.1° | 0.0° |
C6 | N1 | C2 | H2 | 179.9° | 180.0° |
N1 | C2 | N3 | H2 | 180.0° | 180.0° |
N1 | C2 | N3 | C4 | 0.0° | 0.3° |
H2 | C2 | N3 | C4 | 180.0° | 179.7° |