18M
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
OP2 | P | doub | 1.48Å | 1.51Å | |
O5' | P | sing | 1.61Å | 1.61Å | |
P | OP3 | sing | 1.61Å | 1.60Å | |
P | OP1 | sing | 1.61Å | 1.51Å | |
O5' | C5' | sing | 1.43Å | 1.42Å | |
C4' | C5' | sing | 1.53Å | 1.52Å | |
C5' | H5' | sing | 1.09Å | 1.10Å | |
C5' | H5'A | sing | 1.09Å | 1.10Å | |
C3' | C4' | sing | 1.55Å | 1.52Å | |
O4' | C4' | sing | 1.44Å | 1.43Å | |
C4' | H4' | sing | 1.09Å | 1.10Å | |
C1' | O4' | sing | 1.44Å | 1.43Å | |
C2' | C3' | sing | 1.55Å | 1.52Å | |
C3' | O3' | sing | 1.43Å | 1.44Å | |
C3' | H3' | sing | 1.09Å | 1.10Å | |
O3' | P1 | sing | 1.61Å | 1.60Å | |
O2' | C2' | sing | 1.43Å | 1.45Å | |
C2' | C1' | sing | 1.55Å | 1.53Å | |
C2' | H2' | sing | 1.09Å | 1.10Å | |
O2' | CM2 | sing | 1.43Å | 1.44Å | |
N9 | C1' | sing | 1.47Å | 1.49Å | |
C1' | H1' | sing | 1.09Å | 1.10Å | |
C8 | N9 | sing | 1.36Å | 1.35Å | Aromatic |
C4 | N9 | sing | 1.36Å | 1.33Å | Aromatic |
N7 | C8 | doub | 1.30Å | 1.36Å | Aromatic |
C8 | H8 | sing | 1.08Å | 1.08Å | |
N7 | C5 | sing | 1.35Å | 1.34Å | Aromatic |
C6 | C5 | sing | 1.47Å | 1.48Å | |
C5 | C4 | doub | 1.39Å | 1.47Å | Aromatic |
O6 | C6 | doub | 1.22Å | 1.26Å | |
C6 | N1 | sing | 1.34Å | 1.34Å | |
N1 | C2 | doub | 1.32Å | 1.34Å | |
C2 | N3 | sing | 1.36Å | 1.36Å | |
C2 | N2 | sing | 1.37Å | 1.36Å | |
N2 | HN2 | sing | 0.97Å | 1.00Å | |
N2 | HN2A | sing | 0.97Å | 1.00Å | |
C4 | N3 | sing | 1.37Å | 1.35Å | |
N3 | HN3 | sing | 0.97Å | 1.00Å | |
O12 | P1 | doub | 1.48Å | 1.60Å | |
P1 | O13 | sing | 1.61Å | 1.49Å | |
P1 | O11 | sing | 1.61Å | 1.49Å | |
O11 | HO11 | sing | 0.97Å | 0.95Å | |
O13 | HO13 | sing | 0.97Å | 0.95Å | |
CM2 | HM2 | sing | 1.09Å | 1.10Å | |
CM2 | HM2A | sing | 1.09Å | 1.10Å | |
CM2 | HM2B | sing | 1.09Å | 1.10Å | |
OP1 | HOP1 | sing | 0.97Å | 0.95Å | |
OP3 | HOP3 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
OP2 | P | O5' | 110.1° | 109.5° |
OP2 | P | OP3 | 108.0° | 109.5° |
OP2 | P | OP1 | 119.4° | 109.5° |
O5' | P | OP3 | 101.7° | 109.5° |
O5' | P | OP1 | 108.3° | 109.5° |
P | O5' | C5' | 119.8° | 123.0° |
OP3 | P | OP1 | 107.8° | 109.4° |
P | OP3 | HOP3 | 109.5° | 114.0° |
P | OP1 | HOP1 | 109.5° | 114.0° |
O5' | C5' | C4' | 109.9° | 109.5° |
O5' | C5' | H5' | 109.4° | 109.5° |
O5' | C5' | H5'A | 109.4° | 109.5° |
C4' | C5' | H5' | 109.3° | 109.5° |
C4' | C5' | H5'A | 109.4° | 109.4° |
C5' | C4' | C3' | 113.6° | 110.6° |
C5' | C4' | O4' | 110.8° | 110.6° |
C5' | C4' | H4' | 108.2° | 110.6° |
H5' | C5' | H5'A | 109.4° | 109.5° |
C3' | C4' | O4' | 106.6° | 103.6° |
C3' | C4' | H4' | 108.1° | 110.6° |
C4' | C3' | C2' | 104.7° | 102.1° |
C4' | C3' | O3' | 108.0° | 110.9° |
C4' | C3' | H3' | 111.6° | 110.9° |
O4' | C4' | H4' | 109.4° | 110.6° |
C4' | O4' | C1' | 108.5° | 107.0° |
O4' | C1' | C2' | 103.9° | 107.3° |
O4' | C1' | N9 | 110.6° | 109.9° |
O4' | C1' | H1' | 109.3° | 109.9° |
C2' | C3' | O3' | 107.5° | 110.9° |
C2' | C3' | H3' | 111.6° | 110.9° |
C3' | C2' | O2' | 111.8° | 110.5° |
C3' | C2' | C1' | 101.2° | 104.2° |
C3' | C2' | H2' | 108.6° | 110.5° |
O3' | C3' | H3' | 112.9° | 110.9° |
C3' | O3' | P1 | 124.4° | 122.9° |
O3' | P1 | O12 | 101.2° | 109.5° |
O3' | P1 | O13 | 108.8° | 109.4° |
O3' | P1 | O11 | 107.4° | 109.5° |
O2' | C2' | C1' | 116.6° | 110.4° |
O2' | C2' | H2' | 109.6° | 110.6° |
C2' | O2' | CM2 | 119.8° | 114.0° |
C1' | C2' | H2' | 108.5° | 110.5° |
C2' | C1' | N9 | 116.2° | 109.9° |
C2' | C1' | H1' | 108.1° | 109.8° |
O2' | CM2 | HM2 | 109.5° | 109.5° |
O2' | CM2 | HM2A | 109.5° | 109.5° |
O2' | CM2 | HM2B | 109.5° | 109.5° |
N9 | C1' | H1' | 108.6° | 110.0° |
C1' | N9 | C8 | 127.1° | 126.2° |
C1' | N9 | C4 | 124.3° | 126.3° |
C8 | N9 | C4 | 108.6° | 107.5° |
N9 | C8 | N7 | 110.8° | 109.5° |
N9 | C8 | H8 | 124.6° | 125.2° |
N9 | C4 | C5 | 106.2° | 106.4° |
N9 | C4 | N3 | 134.8° | 134.7° |
N7 | C8 | H8 | 124.6° | 125.2° |
C8 | N7 | C5 | 107.6° | 109.1° |
N7 | C5 | C6 | 136.0° | 134.5° |
N7 | C5 | C4 | 106.8° | 107.4° |
C6 | C5 | C4 | 117.2° | 118.1° |
C5 | C6 | O6 | 122.1° | 120.7° |
C5 | C6 | N1 | 117.6° | 118.5° |
C5 | C4 | N3 | 119.1° | 118.9° |
O6 | C6 | N1 | 120.3° | 120.7° |
C6 | N1 | C2 | 122.9° | 121.4° |
N1 | C2 | N3 | 122.5° | 122.5° |
N1 | C2 | N2 | 116.9° | 118.7° |
N3 | C2 | N2 | 120.6° | 118.8° |
C2 | N3 | C4 | 120.7° | 120.6° |
C2 | N3 | HN3 | 119.6° | 119.7° |
C2 | N2 | HN2 | 120.0° | 120.1° |
C2 | N2 | HN2A | 120.0° | 120.0° |
HN2 | N2 | HN2A | 120.0° | 119.9° |
C4 | N3 | HN3 | 119.7° | 119.8° |
O12 | P1 | O13 | 109.7° | 109.4° |
O12 | P1 | O11 | 108.5° | 109.5° |
O13 | P1 | O11 | 119.6° | 109.5° |
P1 | O13 | HO13 | 109.5° | 114.0° |
P1 | O11 | HO11 | 109.5° | 114.0° |
HM2 | CM2 | HM2A | 109.4° | 109.5° |
HM2 | CM2 | HM2B | 109.5° | 109.5° |
HM2A | CM2 | HM2B | 109.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
OP2 | P | O5' | OP3 | 114.4° | 120.0° |
OP2 | P | O5' | OP1 | 132.2° | 120.0° |
OP2 | P | OP3 | OP1 | 130.4° | 120.0° |
OP2 | P | O5' | C5' | 161.3° | 55.1° |
OP2 | P | OP1 | HOP1 | 0.0° | 60.0° |
OP2 | P | OP3 | HOP3 | 0.0° | 180.0° |
O5' | P | OP3 | OP1 | 113.7° | 120.0° |
P | O5' | C5' | C4' | 170.9° | 180.0° |
P | O5' | C5' | H5' | 69.0° | 60.0° |
P | O5' | C5' | H5'A | 50.8° | 60.1° |
O5' | P | OP1 | HOP1 | 127.0° | 180.0° |
O5' | P | OP3 | HOP3 | 115.9° | 60.0° |
OP3 | P | O5' | C5' | 84.3° | 65.0° |
OP3 | P | OP1 | HOP1 | 123.7° | 60.0° |
OP1 | P | O5' | C5' | 29.0° | 175.0° |
OP1 | P | OP3 | HOP3 | 130.4° | 60.0° |
O5' | C5' | C4' | H5' | 120.1° | 120.0° |
O5' | C5' | C4' | H5'A | 120.1° | 119.9° |
O5' | C5' | H5' | H5'A | 119.8° | 120.0° |
O5' | C5' | C4' | C3' | 65.9° | 177.1° |
O5' | C5' | C4' | O4' | 54.1° | 68.6° |
O5' | C5' | C4' | H4' | 174.1° | 54.3° |
C4' | C5' | H5' | H5'A | 119.8° | 120.0° |
C5' | C4' | C3' | O4' | 122.4° | 118.6° |
C5' | C4' | C3' | H4' | 120.1° | 122.8° |
C5' | C4' | O4' | H4' | 119.2° | 122.9° |
C5' | C4' | O4' | C1' | 140.5° | 158.6° |
C5' | C4' | C3' | C2' | 113.6° | 155.5° |
C5' | C4' | C3' | O3' | 132.0° | 86.3° |
C5' | C4' | C3' | H3' | 7.3° | 37.3° |
H5' | C5' | C4' | C3' | 54.2° | 62.8° |
H5' | C5' | C4' | O4' | 174.2° | 51.4° |
H5' | C5' | C4' | H4' | 65.9° | 174.3° |
H5'A | C5' | C4' | C3' | 174.0° | 57.2° |
H5'A | C5' | C4' | O4' | 66.0° | 171.4° |
H5'A | C5' | C4' | H4' | 54.0° | 65.7° |
C3' | C4' | O4' | H4' | 116.7° | 118.6° |
C3' | C4' | O4' | C1' | 16.5° | 40.0° |
C4' | C3' | C2' | O3' | 114.7° | 118.2° |
C4' | C3' | C2' | H3' | 120.9° | 118.2° |
C4' | C3' | O3' | H3' | 123.9° | 123.7° |
C4' | C3' | O3' | P1 | 89.7° | 121.5° |
C4' | C3' | C2' | O2' | 153.1° | 97.8° |
C4' | C3' | C2' | C1' | 28.3° | 20.8° |
C4' | C3' | C2' | H2' | 85.9° | 139.5° |
O4' | C4' | C3' | C2' | 8.7° | 36.9° |
O4' | C4' | C3' | O3' | 105.7° | 155.1° |
O4' | C4' | C3' | H3' | 129.6° | 81.3° |
C4' | O4' | C1' | C2' | 35.0° | 26.4° |
C4' | O4' | C1' | N9 | 160.2° | 145.8° |
C4' | O4' | C1' | H1' | 80.2° | 93.0° |
H4' | C4' | O4' | C1' | 100.2° | 78.6° |
H4' | C4' | C3' | C2' | 126.3° | 81.6° |
H4' | C4' | C3' | O3' | 11.9° | 36.5° |
H4' | C4' | C3' | H3' | 112.8° | 160.2° |
O4' | C1' | C2' | C3' | 38.5° | 2.0° |
O4' | C1' | C2' | O2' | 160.0° | 120.7° |
O4' | C1' | C2' | N9 | 121.6° | 119.4° |
O4' | C1' | C2' | H1' | 116.1° | 119.4° |
O4' | C1' | C2' | H2' | 75.7° | 116.7° |
O4' | C1' | N9 | H1' | 120.0° | 121.2° |
O4' | C1' | N9 | C8 | 74.7° | 22.8° |
O4' | C1' | N9 | C4 | 103.6° | 157.5° |
C2' | C3' | O3' | H3' | 123.6° | 123.7° |
C2' | C3' | O3' | P1 | 157.8° | 125.8° |
C3' | C2' | O2' | C1' | 115.7° | 114.7° |
C3' | C2' | O2' | H2' | 120.5° | 122.6° |
C3' | C2' | C1' | H2' | 114.2° | 118.7° |
C3' | C2' | O2' | CM2 | 90.3° | 150.0° |
C3' | C2' | C1' | N9 | 160.1° | 121.5° |
C3' | C2' | C1' | H1' | 77.6° | 117.4° |
O3' | C3' | C2' | O2' | 38.3° | 20.4° |
O3' | C3' | C2' | C1' | 86.5° | 139.0° |
O3' | C3' | C2' | H2' | 159.4° | 102.3° |
C3' | O3' | P1 | O12 | 132.5° | 55.1° |
C3' | O3' | P1 | O13 | 17.0° | 175.0° |
C3' | O3' | P1 | O11 | 113.8° | 65.0° |
H3' | C3' | O3' | P1 | 34.2° | 2.2° |
H3' | C3' | C2' | O2' | 86.1° | 144.0° |
H3' | C3' | C2' | C1' | 149.1° | 97.4° |
H3' | C3' | C2' | H2' | 35.0° | 21.3° |
O3' | P1 | O12 | O13 | 114.8° | 119.9° |
O3' | P1 | O12 | O11 | 112.9° | 120.1° |
O3' | P1 | O13 | O11 | 123.9° | 120.0° |
O3' | P1 | O11 | HO11 | 108.7° | 60.0° |
O3' | P1 | O13 | HO13 | 109.9° | 180.0° |
O2' | C2' | C1' | H2' | 124.3° | 122.7° |
O2' | C2' | C1' | N9 | 78.4° | 119.9° |
O2' | C2' | C1' | H1' | 43.9° | 1.2° |
C2' | O2' | CM2 | HM2 | 180.0° | 180.0° |
C2' | O2' | CM2 | HM2A | 60.0° | 60.0° |
C2' | O2' | CM2 | HM2B | 60.0° | 60.0° |
C1' | C2' | O2' | CM2 | 25.4° | 95.3° |
C2' | C1' | N9 | H1' | 122.0° | 121.0° |
C2' | C1' | N9 | C8 | 43.3° | 95.0° |
C2' | C1' | N9 | C4 | 138.4° | 84.7° |
H2' | C2' | O2' | CM2 | 149.2° | 27.4° |
H2' | C2' | C1' | N9 | 46.0° | 2.8° |
H2' | C2' | C1' | H1' | 168.2° | 123.9° |
O2' | CM2 | HM2 | HM2A | 120.0° | 120.0° |
O2' | CM2 | HM2 | HM2B | 120.0° | 120.0° |
O2' | CM2 | HM2A | HM2B | 120.0° | 120.0° |
C1' | N9 | C8 | C4 | 178.5° | 179.8° |
C1' | N9 | C8 | N7 | 179.3° | 180.0° |
C1' | N9 | C8 | H8 | 0.7° | 0.0° |
C1' | N9 | C4 | C5 | 179.2° | 179.9° |
C1' | N9 | C4 | N3 | 1.0° | 0.7° |
H1' | C1' | N9 | C8 | 165.3° | 144.0° |
H1' | C1' | N9 | C4 | 16.4° | 36.3° |
N9 | C8 | N7 | H8 | 180.0° | 180.0° |
N9 | C8 | N7 | C5 | 0.6° | 0.0° |
C8 | N9 | C4 | C5 | 0.6° | 0.4° |
C8 | N9 | C4 | N3 | 179.5° | 179.6° |
C4 | N9 | C8 | N7 | 0.8° | 0.2° |
C4 | N9 | C8 | H8 | 179.2° | 179.8° |
N9 | C4 | C5 | N7 | 0.3° | 0.4° |
N9 | C4 | C5 | C6 | 179.9° | 179.9° |
N9 | C4 | C5 | N3 | 179.9° | 179.3° |
N9 | C4 | N3 | C2 | 179.6° | 179.6° |
N9 | C4 | N3 | HN3 | 0.4° | 0.6° |
C8 | N7 | C5 | C6 | 179.6° | 180.0° |
C8 | N7 | C5 | C4 | 0.2° | 0.3° |
H8 | C8 | N7 | C5 | 179.4° | 180.0° |
N7 | C5 | C6 | C4 | 179.8° | 179.7° |
N7 | C5 | C6 | O6 | 0.0° | 0.1° |
N7 | C5 | C6 | N1 | 179.7° | 180.0° |
N7 | C5 | C4 | N3 | 179.9° | 179.7° |
C5 | C6 | O6 | N1 | 179.7° | 179.9° |
C5 | C6 | N1 | C2 | 0.7° | 0.1° |
C6 | C5 | C4 | N3 | 0.0° | 0.5° |
C4 | C5 | C6 | O6 | 179.8° | 179.8° |
C4 | C5 | C6 | N1 | 0.4° | 0.3° |
C5 | C4 | N3 | C2 | 0.2° | 0.5° |
C5 | C4 | N3 | HN3 | 179.8° | 179.7° |
O6 | C6 | N1 | C2 | 179.5° | 180.0° |
C6 | N1 | C2 | N3 | 0.5° | 0.0° |
C6 | N1 | C2 | N2 | 179.6° | 180.0° |
N1 | C2 | N3 | N2 | 179.9° | 180.0° |
N1 | C2 | N2 | HN2 | 0.0° | 0.0° |
N1 | C2 | N2 | HN2A | 180.0° | 180.0° |
N1 | C2 | N3 | C4 | 0.0° | 0.2° |
N1 | C2 | N3 | HN3 | 180.0° | 180.0° |
N3 | C2 | N2 | HN2 | 179.9° | 180.0° |
N3 | C2 | N2 | HN2A | 0.1° | 0.0° |
C2 | N3 | C4 | HN3 | 180.0° | 179.8° |
C2 | N2 | HN2 | HN2A | 180.0° | 180.0° |
N2 | C2 | N3 | C4 | 179.9° | 179.8° |
N2 | C2 | N3 | HN3 | 0.1° | 0.0° |
O12 | P1 | O13 | O11 | 126.2° | 120.0° |
O12 | P1 | O11 | HO11 | 0.0° | 180.0° |
O12 | P1 | O13 | HO13 | 0.0° | 60.0° |
O13 | P1 | O11 | HO11 | 126.8° | 60.0° |
O11 | P1 | O13 | HO13 | 126.2° | 60.0° |
HM2 | CM2 | HM2A | HM2B | 120.0° | 120.0° |