8MG
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
P | OP3 | sing | 1.62Å | 1.49Å | |
P | OP2 | sing | 1.62Å | 1.49Å | |
P | O5' | sing | 1.62Å | 1.59Å | |
P | OP1 | doub | 1.50Å | 73.44Å | |
OP3 | H3P | sing | 0.98Å | 0.95Å | |
OP2 | H2P | sing | 0.98Å | 0.95Å | |
O5' | C5' | sing | 1.42Å | 1.43Å | |
N9 | C4 | sing | 1.37Å | 1.37Å | Aromatic |
N9 | C8 | sing | 1.38Å | 1.37Å | Aromatic |
N9 | C1' | sing | 1.46Å | 1.46Å | |
C4 | N3 | sing | 1.35Å | 1.35Å | |
C4 | C5 | doub | 1.37Å | 1.38Å | Aromatic |
N3 | C2 | doub | 1.32Å | 1.32Å | |
C2 | N2 | sing | 1.37Å | 1.34Å | |
C2 | N1 | sing | 1.42Å | 1.37Å | |
N2 | H21 | sing | 0.99Å | 1.01Å | |
N2 | H22 | sing | 0.99Å | 1.01Å | |
N1 | C6 | sing | 1.40Å | 1.39Å | |
N1 | H1 | sing | 1.02Å | 1.01Å | |
C6 | O6 | doub | 1.22Å | 1.24Å | |
C6 | C5 | sing | 1.44Å | 1.42Å | |
C5 | N7 | sing | 1.36Å | 1.39Å | Aromatic |
N7 | C8 | doub | 1.32Å | 1.31Å | Aromatic |
C8 | C | sing | 1.48Å | 1.34Å | |
C2' | C1' | sing | 1.52Å | 1.53Å | |
C2' | C3' | sing | 1.51Å | 1.52Å | |
C2' | H2' | sing | 1.10Å | 1.09Å | |
C2' | H2'' | sing | 1.09Å | 1.09Å | |
C5' | C4' | sing | 1.52Å | 1.51Å | |
C5' | H5' | sing | 1.09Å | 1.09Å | |
C5' | H5'' | sing | 1.09Å | 1.09Å | |
C4' | O4' | sing | 1.44Å | 1.44Å | |
C4' | C3' | sing | 1.52Å | 1.52Å | |
C4' | H4' | sing | 1.10Å | 1.09Å | |
O4' | C1' | sing | 1.44Å | 1.42Å | |
C1' | H1' | sing | 1.10Å | 1.09Å | |
C3' | O3' | sing | 1.43Å | 1.43Å | |
C3' | H3' | sing | 1.09Å | 1.09Å | |
O3' | HO3' | sing | 0.97Å | 0.95Å | |
C | HC1 | sing | 1.10Å | 1.09Å | |
C | HC2 | sing | 1.10Å | 1.09Å | |
C | HC3 | sing | 1.10Å | 1.09Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
OP3 | P | OP2 | 119.5° | 103.3° |
OP3 | P | O5' | 108.2° | 103.7° |
OP3 | P | OP1 | 38.3° | 115.3° |
P | OP3 | H3P | 119.6° | 118.9° |
OP2 | P | O5' | 108.1° | 102.9° |
OP2 | P | OP1 | 86.4° | 115.0° |
P | OP2 | H2P | 119.5° | 118.9° |
O5' | P | OP1 | 142.2° | 115.0° |
P | O5' | C5' | 121.1° | 118.5° |
O5' | C5' | C4' | 110.4° | 108.7° |
O5' | C5' | H5' | 109.5° | 109.2° |
O5' | C5' | H5'' | 109.6° | 109.2° |
C4 | N9 | C8 | 106.4° | 106.4° |
C4 | N9 | C1' | 127.1° | 126.7° |
N9 | C4 | N3 | 126.1° | 125.9° |
N9 | C4 | C5 | 105.3° | 105.0° |
C8 | N9 | C1' | 126.5° | 126.8° |
N9 | C8 | N7 | 113.1° | 112.5° |
N9 | C8 | C | 123.9° | 121.7° |
N9 | C1' | C2' | 114.6° | 114.3° |
N9 | C1' | O4' | 107.7° | 110.0° |
N9 | C1' | H1' | 108.3° | 105.9° |
N3 | C4 | C5 | 128.6° | 129.1° |
C4 | N3 | C2 | 111.9° | 113.0° |
C4 | C5 | C6 | 118.8° | 119.2° |
C4 | C5 | N7 | 110.8° | 112.1° |
N3 | C2 | N2 | 119.6° | 122.1° |
N3 | C2 | N1 | 124.1° | 122.6° |
N2 | C2 | N1 | 116.3° | 115.3° |
C2 | N2 | H21 | 119.6° | 118.2° |
C2 | N2 | H22 | 120.1° | 118.3° |
C2 | N1 | C6 | 125.0° | 125.2° |
C2 | N1 | H1 | 118.0° | 117.4° |
H21 | N2 | H22 | 120.3° | 123.5° |
C6 | N1 | H1 | 117.0° | 117.4° |
N1 | C6 | O6 | 119.8° | 125.4° |
N1 | C6 | C5 | 111.6° | 110.9° |
O6 | C6 | C5 | 128.6° | 123.8° |
C6 | C5 | N7 | 130.4° | 128.7° |
C5 | N7 | C8 | 104.3° | 103.9° |
N7 | C8 | C | 121.3° | 125.7° |
C8 | C | HC1 | 109.4° | 111.0° |
C8 | C | HC2 | 109.5° | 111.9° |
C8 | C | HC3 | 109.4° | 111.9° |
C1' | C2' | C3' | 104.8° | 101.6° |
C1' | C2' | H2' | 112.3° | 110.5° |
C1' | C2' | H2'' | 109.7° | 111.7° |
C2' | C1' | O4' | 107.6° | 106.7° |
C2' | C1' | H1' | 110.6° | 111.7° |
C3' | C2' | H2' | 111.2° | 110.0° |
C3' | C2' | H2'' | 111.3° | 114.2° |
C2' | C3' | C4' | 103.4° | 103.2° |
C2' | C3' | O3' | 110.8° | 108.4° |
C2' | C3' | H3' | 111.7° | 113.7° |
H2' | C2' | H2'' | 107.6° | 108.7° |
C4' | C5' | H5' | 109.1° | 110.1° |
C4' | C5' | H5'' | 109.0° | 110.1° |
C5' | C4' | O4' | 110.1° | 108.0° |
C5' | C4' | C3' | 114.9° | 112.7° |
C5' | C4' | H4' | 107.6° | 109.4° |
H5' | C5' | H5'' | 109.1° | 109.6° |
O4' | C4' | C3' | 104.7° | 106.8° |
O4' | C4' | H4' | 113.1° | 107.7° |
C4' | O4' | C1' | 109.4° | 108.7° |
C3' | C4' | H4' | 106.6° | 112.0° |
C4' | C3' | O3' | 110.1° | 109.6° |
C4' | C3' | H3' | 111.3° | 114.0° |
O4' | C1' | H1' | 107.9° | 108.1° |
O3' | C3' | H3' | 109.4° | 107.8° |
C3' | O3' | HO3' | 110.8° | 106.6° |
HC1 | C | HC2 | 109.6° | 107.9° |
HC1 | C | HC3 | 109.4° | 107.8° |
HC2 | C | HC3 | 109.5° | 106.1° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
OP3 | P | OP2 | O5' | 124.2° | 107.7° |
OP3 | P | OP2 | OP1 | 20.1° | 126.5° |
OP3 | P | O5' | OP1 | 22.4° | 126.8° |
OP3 | P | OP2 | H2P | 179.9° | 78.5° |
OP3 | P | O5' | C5' | 14.5° | 53.2° |
OP2 | P | O5' | OP1 | 108.3° | 125.8° |
OP2 | P | OP3 | H3P | 180.0° | 77.5° |
OP2 | P | O5' | C5' | 145.3° | 54.2° |
O5' | P | OP3 | H3P | 55.8° | 175.4° |
O5' | P | OP2 | H2P | 55.8° | 173.9° |
P | O5' | C5' | C4' | 145.8° | 180.0° |
P | O5' | C5' | H5' | 94.1° | 59.9° |
P | O5' | C5' | H5'' | 25.7° | 59.9° |
OP1 | P | OP3 | H3P | 146.3° | 48.8° |
OP1 | P | OP2 | H2P | 159.8° | 48.0° |
OP1 | P | O5' | C5' | 37.0° | 180.0° |
O5' | C5' | C4' | H5' | 120.4° | 119.6° |
O5' | C5' | C4' | H5'' | 120.5° | 119.5° |
O5' | C5' | H5' | H5'' | 120.0° | 119.6° |
O5' | C5' | C4' | O4' | 1.1° | 61.8° |
O5' | C5' | C4' | C3' | 119.0° | 179.5° |
O5' | C5' | C4' | H4' | 122.5° | 55.2° |
C4 | N9 | C8 | C1' | 180.0° | 180.0° |
N9 | C4 | N3 | C5 | 179.8° | 179.9° |
N9 | C4 | N3 | C2 | 179.8° | 180.0° |
N9 | C4 | C5 | C6 | 179.8° | 180.0° |
N9 | C4 | C5 | N7 | 0.1° | 0.0° |
C4 | N9 | C8 | N7 | 0.2° | 0.0° |
C4 | N9 | C8 | C | 164.9° | 179.9° |
C4 | N9 | C1' | C2' | 30.5° | 116.6° |
C4 | N9 | C1' | O4' | 89.2° | 3.4° |
C4 | N9 | C1' | H1' | 154.4° | 120.0° |
C8 | N9 | C4 | N3 | 179.9° | 180.0° |
C8 | N9 | C4 | C5 | 0.2° | 0.0° |
N9 | C8 | N7 | C5 | 0.2° | 0.0° |
N9 | C8 | N7 | C | 165.6° | 180.0° |
C8 | N9 | C1' | C2' | 149.6° | 63.4° |
C8 | N9 | C1' | O4' | 90.8° | 176.6° |
C8 | N9 | C1' | H1' | 25.6° | 60.1° |
N9 | C8 | C | HC1 | 72.7° | 140.2° |
N9 | C8 | C | HC2 | 167.2° | 99.2° |
N9 | C8 | C | HC3 | 47.2° | 19.7° |
C1' | N9 | C4 | N3 | 0.0° | 0.0° |
C1' | N9 | C4 | C5 | 179.8° | 179.9° |
C1' | N9 | C8 | N7 | 179.8° | 179.9° |
C1' | N9 | C8 | C | 15.1° | 0.1° |
N9 | C1' | C2' | O4' | 119.7° | 121.8° |
N9 | C1' | C2' | H1' | 122.7° | 120.3° |
N9 | C1' | C2' | C3' | 114.1° | 154.5° |
N9 | C1' | C2' | H2' | 6.7° | 37.8° |
N9 | C1' | C2' | H2'' | 126.3° | 83.3° |
N9 | C1' | O4' | C4' | 139.1° | 141.8° |
N9 | C1' | O4' | H1' | 116.7° | 115.2° |
C4 | N3 | C2 | N2 | 179.8° | 180.0° |
C4 | N3 | C2 | N1 | 0.1° | 0.0° |
N3 | C4 | C5 | C6 | 0.1° | 0.0° |
N3 | C4 | C5 | N7 | 180.0° | 180.0° |
C5 | C4 | N3 | C2 | 0.0° | 0.0° |
C4 | C5 | C6 | N1 | 0.0° | 0.0° |
C4 | C5 | C6 | O6 | 180.0° | 180.0° |
C4 | C5 | C6 | N7 | 179.9° | 180.0° |
C4 | C5 | N7 | C8 | 0.0° | 0.0° |
N3 | C2 | N2 | N1 | 179.9° | 180.0° |
N3 | C2 | N2 | H21 | 0.0° | 136.4° |
N3 | C2 | N2 | H22 | 179.4° | 43.5° |
N3 | C2 | N1 | C6 | 0.2° | 0.0° |
N3 | C2 | N1 | H1 | 179.7° | 180.0° |
C2 | N2 | H21 | H22 | 179.4° | 180.0° |
N2 | C2 | N1 | C6 | 179.8° | 180.0° |
N2 | C2 | N1 | H1 | 0.3° | 0.0° |
N1 | C2 | N2 | H21 | 179.9° | 43.6° |
N1 | C2 | N2 | H22 | 0.5° | 136.4° |
C2 | N1 | C6 | H1 | 179.9° | 179.9° |
C2 | N1 | C6 | O6 | 179.9° | 180.0° |
C2 | N1 | C6 | C5 | 0.1° | 0.0° |
N1 | C6 | O6 | C5 | 180.0° | 180.0° |
N1 | C6 | C5 | N7 | 179.9° | 180.0° |
H1 | N1 | C6 | O6 | 0.2° | 0.0° |
H1 | N1 | C6 | C5 | 179.8° | 180.0° |
O6 | C6 | C5 | N7 | 0.1° | 0.0° |
C6 | C5 | N7 | C8 | 179.9° | 180.0° |
C5 | N7 | C8 | C | 165.4° | 180.0° |
N7 | C8 | C | HC1 | 123.4° | 39.8° |
N7 | C8 | C | HC2 | 3.2° | 80.8° |
N7 | C8 | C | HC3 | 116.8° | 160.2° |
C8 | C | HC1 | HC2 | 120.1° | 122.9° |
C8 | C | HC1 | HC3 | 119.9° | 122.9° |
C8 | C | HC2 | HC3 | 120.0° | 122.3° |
C1' | C2' | C3' | H2' | 121.5° | 117.0° |
C1' | C2' | C3' | H2'' | 118.5° | 120.4° |
C1' | C2' | H2' | H2'' | 120.8° | 122.9° |
C2' | C1' | O4' | C4' | 15.1° | 17.3° |
C1' | C2' | C3' | C4' | 22.5° | 34.8° |
C2' | C1' | O4' | H1' | 119.3° | 120.3° |
C1' | C2' | C3' | O3' | 140.4° | 81.3° |
C1' | C2' | C3' | H3' | 97.3° | 158.8° |
C3' | C2' | H2' | H2'' | 122.1° | 125.7° |
C2' | C3' | C4' | C5' | 152.5° | 92.6° |
C2' | C3' | C4' | O4' | 31.6° | 25.9° |
C2' | C3' | C4' | O3' | 118.4° | 115.3° |
C2' | C3' | C4' | H3' | 120.1° | 123.7° |
C2' | C3' | C4' | H4' | 88.4° | 143.6° |
C3' | C2' | C1' | O4' | 5.6° | 32.7° |
C3' | C2' | C1' | H1' | 123.2° | 85.2° |
C2' | C3' | O3' | H3' | 123.6° | 123.5° |
C2' | C3' | O3' | HO3' | 180.0° | 65.3° |
H2' | C2' | C3' | C4' | 144.0° | 82.2° |
H2' | C2' | C1' | O4' | 126.4° | 84.0° |
H2' | C2' | C1' | H1' | 116.0° | 158.1° |
H2' | C2' | C3' | O3' | 98.1° | 161.6° |
H2' | C2' | C3' | H3' | 24.2° | 41.7° |
H2'' | C2' | C3' | C4' | 96.0° | 155.2° |
H2'' | C2' | C1' | O4' | 114.0° | 154.9° |
H2'' | C2' | C1' | H1' | 3.6° | 37.0° |
H2'' | C2' | C3' | O3' | 21.9° | 39.1° |
H2'' | C2' | C3' | H3' | 144.2° | 80.8° |
C4' | C5' | H5' | H5'' | 119.0° | 121.2° |
C5' | C4' | O4' | C3' | 124.0° | 121.5° |
C5' | C4' | O4' | H4' | 120.3° | 118.0° |
C5' | C4' | C3' | H4' | 119.1° | 123.8° |
C5' | C4' | O4' | C1' | 153.6° | 116.0° |
C5' | C4' | C3' | O3' | 89.1° | 152.1° |
C5' | C4' | C3' | H3' | 32.4° | 31.2° |
H5' | C5' | C4' | O4' | 121.5° | 57.8° |
H5' | C5' | C4' | C3' | 120.6° | 60.0° |
H5' | C5' | C4' | H4' | 2.1° | 174.7° |
H5'' | C5' | C4' | O4' | 119.4° | 178.7° |
H5'' | C5' | C4' | C3' | 1.6° | 60.9° |
H5'' | C5' | C4' | H4' | 117.0° | 64.3° |
O4' | C4' | C3' | H4' | 120.1° | 117.7° |
C4' | O4' | C1' | H1' | 104.3° | 103.1° |
O4' | C4' | C3' | O3' | 150.0° | 89.4° |
O4' | C4' | C3' | H3' | 88.5° | 149.7° |
C3' | C4' | O4' | C1' | 29.6° | 5.5° |
C4' | C3' | O3' | H3' | 122.6° | 124.6° |
C4' | C3' | O3' | HO3' | 66.2° | 46.6° |
H4' | C4' | O4' | C1' | 86.1° | 126.0° |
H4' | C4' | C3' | O3' | 30.0° | 28.3° |
H4' | C4' | C3' | H3' | 151.5° | 92.6° |
H3' | C3' | O3' | HO3' | 56.4° | 171.2° |
HC1 | C | HC2 | HC3 | 120.0° | 115.3° |