8DT
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O3' | C3' | sing | 1.43Å | 1.44Å | |
C3' | C4' | sing | 1.55Å | 1.49Å | |
C3' | C2' | sing | 1.55Å | 1.52Å | |
C4' | C5' | sing | 1.53Å | 1.50Å | |
C4' | O4' | sing | 1.44Å | 1.44Å | |
OP1 | P | doub | 1.48Å | 1.51Å | |
C2' | C1' | sing | 1.54Å | 1.53Å | |
C5' | O5' | sing | 1.43Å | 1.43Å | |
O4' | C1' | sing | 1.44Å | 1.41Å | |
C1' | N1 | sing | 1.46Å | 1.45Å | |
O5' | P | sing | 1.61Å | 1.63Å | |
P | OP2 | sing | 1.61Å | 1.53Å | |
O2 | C2 | doub | 1.22Å | 1.25Å | |
N1 | C2 | sing | 1.34Å | 1.37Å | |
N1 | C6 | sing | 1.37Å | 1.34Å | |
C2 | N3 | sing | 1.35Å | 1.37Å | |
C6 | C5 | doub | 1.37Å | 1.39Å | |
N3 | C4 | sing | 1.35Å | 1.37Å | |
C5 | C4 | sing | 1.47Å | 1.38Å | |
C5 | C7 | sing | 1.48Å | 1.49Å | |
C4 | O4 | doub | 1.22Å | 1.26Å | |
C7 | C1 | doub | 1.33Å | 1.33Å | |
C1 | C3 | sing | 1.51Å | 1.51Å | |
C3 | N9 | sing | 1.46Å | 1.46Å | |
N9 | C32 | sing | 1.35Å | 1.35Å | |
O34 | C32 | doub | 1.21Å | 1.27Å | |
C32 | C33 | sing | 1.51Å | 1.54Å | |
OP2 | H2 | sing | 0.97Å | 0.95Å | |
C5' | H3 | sing | 1.09Å | 1.10Å | |
C5' | H4 | sing | 1.09Å | 1.10Å | |
C4' | H5 | sing | 1.09Å | 1.10Å | |
C3' | H6 | sing | 1.09Å | 1.10Å | |
O3' | H7 | sing | 0.97Å | 0.95Å | |
C2' | H8 | sing | 1.09Å | 1.10Å | |
C2' | H9 | sing | 1.09Å | 1.10Å | |
C1' | H10 | sing | 1.09Å | 1.10Å | |
C6 | H11 | sing | 1.08Å | 1.08Å | |
N3 | H12 | sing | 0.97Å | 1.00Å | |
C7 | H13 | sing | 1.08Å | 1.08Å | |
C1 | H14 | sing | 1.08Å | 1.08Å | |
C3 | H15 | sing | 1.09Å | 1.10Å | |
C3 | H16 | sing | 1.09Å | 1.10Å | |
N9 | H17 | sing | 0.97Å | 1.00Å | |
C33 | H18 | sing | 1.09Å | 1.10Å | |
C33 | H19 | sing | 1.09Å | 1.10Å | |
C33 | H20 | sing | 1.09Å | 1.10Å | |
P | OP3 | sing | 1.61Å | 1.54Å | |
OP3 | H1 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O3' | C3' | C4' | 110.9° | 110.9° |
O3' | C3' | C2' | 105.3° | 110.9° |
O3' | C3' | H6 | 112.9° | 110.8° |
C3' | O3' | H7 | 109.5° | 114.0° |
C4' | C3' | C2' | 103.4° | 102.1° |
C3' | C4' | C5' | 117.2° | 110.6° |
C3' | C4' | O4' | 106.5° | 103.5° |
C3' | C4' | H5 | 108.1° | 110.7° |
C4' | C3' | H6 | 112.0° | 110.9° |
C3' | C2' | C1' | 102.0° | 104.2° |
C2' | C3' | H6 | 111.7° | 110.9° |
C3' | C2' | H8 | 111.3° | 110.5° |
C3' | C2' | H9 | 111.3° | 110.5° |
C5' | C4' | O4' | 108.0° | 110.6° |
C4' | C5' | O5' | 115.0° | 109.5° |
C4' | C5' | H3 | 108.0° | 109.5° |
C4' | C5' | H4 | 108.1° | 109.5° |
C5' | C4' | H5 | 108.1° | 110.5° |
C4' | O4' | C1' | 110.7° | 107.0° |
O4' | C4' | H5 | 108.7° | 110.6° |
OP1 | P | O5' | 98.3° | 109.5° |
OP1 | P | OP2 | 108.7° | 109.4° |
OP1 | P | OP3 | 128.2° | 109.5° |
C2' | C1' | O4' | 104.5° | 107.3° |
C2' | C1' | N1 | 114.8° | 109.9° |
C1' | C2' | H8 | 111.3° | 110.5° |
C1' | C2' | H9 | 111.3° | 110.5° |
C2' | C1' | H10 | 108.6° | 109.9° |
C5' | O5' | P | 115.6° | 123.0° |
O5' | C5' | H3 | 108.1° | 109.4° |
O5' | C5' | H4 | 108.1° | 109.5° |
O4' | C1' | N1 | 108.9° | 109.9° |
O4' | C1' | H10 | 110.3° | 109.8° |
C1' | N1 | C2 | 120.0° | 119.3° |
C1' | N1 | C6 | 119.2° | 119.3° |
N1 | C1' | H10 | 109.7° | 110.0° |
O5' | P | OP2 | 98.8° | 109.5° |
O5' | P | OP3 | 106.9° | 109.5° |
P | OP2 | H2 | 109.5° | 114.0° |
OP2 | P | OP3 | 111.1° | 109.5° |
O2 | C2 | N1 | 116.9° | 119.1° |
O2 | C2 | N3 | 122.4° | 119.0° |
C2 | N1 | C6 | 120.6° | 121.4° |
N1 | C2 | N3 | 120.7° | 121.9° |
N1 | C6 | C5 | 120.4° | 119.5° |
N1 | C6 | H11 | 119.8° | 120.2° |
C2 | N3 | C4 | 118.6° | 120.3° |
C2 | N3 | H12 | 120.7° | 119.9° |
C6 | C5 | C4 | 118.6° | 118.3° |
C6 | C5 | C7 | 115.9° | 120.8° |
C5 | C6 | H11 | 119.8° | 120.3° |
N3 | C4 | C5 | 121.0° | 118.7° |
N3 | C4 | O4 | 119.5° | 120.7° |
C4 | N3 | H12 | 120.7° | 119.9° |
C4 | C5 | C7 | 125.4° | 120.9° |
C5 | C4 | O4 | 119.4° | 120.7° |
C5 | C7 | C1 | 124.0° | 120.0° |
C5 | C7 | H13 | 118.0° | 120.0° |
C7 | C1 | C3 | 123.4° | 120.0° |
C1 | C7 | H13 | 118.0° | 120.0° |
C7 | C1 | H14 | 118.3° | 120.0° |
C1 | C3 | N9 | 101.0° | 109.4° |
C3 | C1 | H14 | 118.3° | 120.0° |
C1 | C3 | H15 | 111.5° | 109.5° |
C1 | C3 | H16 | 111.5° | 109.5° |
C3 | N9 | C32 | 127.7° | 120.0° |
N9 | C3 | H15 | 111.5° | 109.5° |
N9 | C3 | H16 | 111.5° | 109.4° |
C3 | N9 | H17 | 116.2° | 120.0° |
N9 | C32 | O34 | 122.8° | 120.0° |
N9 | C32 | C33 | 111.3° | 120.0° |
C32 | N9 | H17 | 116.2° | 119.9° |
O34 | C32 | C33 | 125.8° | 120.0° |
C32 | C33 | H18 | 109.5° | 109.4° |
C32 | C33 | H19 | 109.5° | 109.5° |
C32 | C33 | H20 | 109.5° | 109.5° |
H3 | C5' | H4 | 109.5° | 109.5° |
H8 | C2' | H9 | 109.5° | 110.5° |
H15 | C3 | H16 | 109.5° | 109.5° |
H18 | C33 | H19 | 109.4° | 109.5° |
H18 | C33 | H20 | 109.5° | 109.5° |
H19 | C33 | H20 | 109.5° | 109.4° |
P | OP3 | H1 | 109.5° | 114.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O3' | C3' | C4' | C2' | 112.4° | 118.2° |
O3' | C3' | C4' | H6 | 127.1° | 123.6° |
O3' | C3' | C2' | H6 | 122.9° | 123.6° |
O3' | C3' | C4' | C5' | 150.0° | 86.2° |
O3' | C3' | C4' | O4' | 89.0° | 155.2° |
O3' | C3' | C2' | C1' | 82.2° | 139.1° |
O3' | C3' | C4' | H5 | 27.7° | 36.6° |
O3' | C3' | C2' | H8 | 159.0° | 102.3° |
O3' | C3' | C2' | H9 | 36.6° | 20.4° |
C4' | C3' | C2' | H6 | 120.7° | 118.2° |
C3' | C4' | C5' | O4' | 120.2° | 114.1° |
C3' | C4' | C5' | H5 | 122.3° | 123.0° |
C3' | C4' | O4' | H5 | 116.2° | 118.6° |
C4' | C3' | C2' | C1' | 34.3° | 20.9° |
C3' | C4' | C5' | O5' | 42.6° | 179.5° |
C3' | C4' | O4' | C1' | 2.2° | 40.0° |
C3' | C4' | C5' | H3 | 163.4° | 60.6° |
C3' | C4' | C5' | H4 | 78.3° | 59.4° |
C4' | C3' | O3' | H7 | 180.0° | 180.0° |
C4' | C3' | C2' | H8 | 84.5° | 139.5° |
C4' | C3' | C2' | H9 | 153.1° | 97.8° |
C2' | C3' | C4' | C5' | 97.6° | 155.5° |
C2' | C3' | C4' | O4' | 23.4° | 37.0° |
C3' | C2' | C1' | H8 | 118.8° | 118.7° |
C3' | C2' | C1' | H9 | 118.8° | 118.7° |
C3' | C2' | C1' | O4' | 33.4° | 2.0° |
C3' | C2' | C1' | N1 | 152.6° | 121.5° |
C2' | C3' | C4' | H5 | 140.1° | 81.6° |
C2' | C3' | O3' | H7 | 68.7° | 67.3° |
C3' | C2' | H8 | H9 | 123.5° | 122.6° |
C3' | C2' | C1' | H10 | 84.2° | 117.3° |
C5' | C4' | O4' | H5 | 117.0° | 122.8° |
C4' | C5' | O5' | H3 | 120.8° | 119.9° |
C4' | C5' | O5' | H4 | 120.8° | 120.0° |
C5' | C4' | O4' | C1' | 124.6° | 158.6° |
C4' | C5' | O5' | P | 166.8° | 180.0° |
C4' | C5' | H3 | H4 | 117.5° | 120.0° |
C5' | C4' | C3' | H6 | 22.8° | 37.4° |
C4' | O4' | C1' | C2' | 19.9° | 26.5° |
O4' | C4' | C5' | O5' | 77.7° | 66.4° |
C4' | O4' | C1' | N1 | 143.0° | 145.9° |
O4' | C4' | C5' | H3 | 43.1° | 53.5° |
O4' | C4' | C5' | H4 | 161.5° | 173.5° |
O4' | C4' | C3' | H6 | 143.9° | 81.2° |
C4' | O4' | C1' | H10 | 96.6° | 92.9° |
OP1 | P | O5' | C5' | 61.0° | 55.0° |
OP1 | P | O5' | OP2 | 110.6° | 120.0° |
OP1 | P | O5' | OP3 | 134.2° | 120.0° |
OP1 | P | OP2 | OP3 | 146.1° | 120.0° |
OP1 | P | OP2 | H2 | 0.0° | 180.0° |
OP1 | P | OP3 | H1 | 0.0° | 60.0° |
C2' | C1' | O4' | N1 | 123.1° | 119.5° |
C2' | C1' | O4' | H10 | 116.5° | 119.4° |
C2' | C1' | N1 | H10 | 122.6° | 121.1° |
C2' | C1' | N1 | C2 | 118.5° | 65.0° |
C2' | C1' | N1 | C6 | 66.0° | 115.3° |
C1' | C2' | C3' | H6 | 154.9° | 97.3° |
C1' | C2' | H8 | H9 | 123.5° | 122.6° |
C5' | O5' | P | OP2 | 171.6° | 65.0° |
O5' | C5' | H3 | H4 | 117.5° | 120.0° |
O5' | C5' | C4' | H5 | 164.9° | 56.5° |
C5' | O5' | P | OP3 | 73.2° | 175.0° |
O4' | C1' | N1 | H10 | 120.7° | 121.1° |
O4' | C1' | N1 | C2 | 124.8° | 52.8° |
O4' | C1' | N1 | C6 | 50.7° | 126.9° |
C1' | O4' | C4' | H5 | 118.4° | 78.6° |
O4' | C1' | C2' | H8 | 85.3° | 116.7° |
O4' | C1' | C2' | H9 | 152.2° | 120.7° |
C1' | N1 | C2 | O2 | 1.0° | 0.1° |
C1' | N1 | C2 | C6 | 175.4° | 179.7° |
C1' | N1 | C2 | N3 | 177.6° | 180.0° |
C1' | N1 | C6 | C5 | 179.6° | 180.0° |
N1 | C1' | C2' | H8 | 33.8° | 2.8° |
N1 | C1' | C2' | H9 | 88.6° | 119.9° |
C1' | N1 | C6 | H11 | 0.4° | 0.0° |
O5' | P | OP2 | OP3 | 112.0° | 120.0° |
O5' | P | OP2 | H2 | 101.9° | 60.0° |
P | O5' | C5' | H3 | 72.4° | 60.0° |
P | O5' | C5' | H4 | 46.0° | 60.0° |
O5' | P | OP3 | H1 | 115.5° | 180.0° |
OP2 | P | OP3 | H1 | 137.8° | 59.9° |
O2 | C2 | N1 | N3 | 178.6° | 179.9° |
O2 | C2 | N1 | C6 | 176.4° | 179.8° |
O2 | C2 | N3 | C4 | 178.8° | 180.0° |
O2 | C2 | N3 | H12 | 1.2° | 0.1° |
C2 | N1 | C6 | C5 | 4.1° | 0.3° |
N1 | C2 | N3 | C4 | 0.3° | 0.0° |
C2 | N1 | C1' | H10 | 4.1° | 173.9° |
C2 | N1 | C6 | H11 | 175.9° | 179.7° |
N1 | C2 | N3 | H12 | 179.8° | 180.0° |
C6 | N1 | C2 | N3 | 2.2° | 0.3° |
N1 | C6 | C5 | H11 | 180.0° | 180.0° |
N1 | C6 | C5 | C4 | 3.6° | 0.1° |
N1 | C6 | C5 | C7 | 178.1° | 180.0° |
C6 | N1 | C1' | H10 | 171.4° | 5.8° |
C2 | N3 | C4 | H12 | 180.0° | 180.0° |
C2 | N3 | C4 | C5 | 0.8° | 0.2° |
C2 | N3 | C4 | O4 | 179.5° | 179.9° |
C6 | C5 | C4 | N3 | 1.1° | 0.2° |
C6 | C5 | C4 | C7 | 178.2° | 180.0° |
C6 | C5 | C4 | O4 | 177.6° | 180.0° |
C6 | C5 | C7 | C1 | 175.2° | 174.4° |
C6 | C5 | C7 | H13 | 4.9° | 5.6° |
N3 | C4 | C5 | O4 | 178.7° | 179.9° |
N3 | C4 | C5 | C7 | 179.3° | 179.8° |
C4 | C5 | C7 | C1 | 3.1° | 5.6° |
C4 | C5 | C6 | H11 | 176.4° | 180.0° |
C5 | C4 | N3 | H12 | 179.3° | 179.8° |
C4 | C5 | C7 | H13 | 176.9° | 174.4° |
C7 | C5 | C4 | O4 | 0.6° | 0.1° |
C5 | C7 | C1 | H13 | 180.0° | 179.9° |
C5 | C7 | C1 | C3 | 176.8° | 175.0° |
C7 | C5 | C6 | H11 | 1.9° | 0.0° |
C5 | C7 | C1 | H14 | 3.2° | 5.1° |
O4 | C4 | N3 | H12 | 0.5° | 0.1° |
C7 | C1 | C3 | H14 | 180.0° | 179.9° |
C7 | C1 | C3 | N9 | 177.8° | 125.0° |
C7 | C1 | C3 | H15 | 63.6° | 115.0° |
C7 | C1 | C3 | H16 | 59.1° | 5.1° |
C1 | C3 | N9 | H15 | 118.6° | 120.0° |
C1 | C3 | N9 | H16 | 118.6° | 120.0° |
C1 | C3 | N9 | C32 | 104.4° | 180.0° |
C3 | C1 | C7 | H13 | 3.2° | 5.0° |
C1 | C3 | H15 | H16 | 123.9° | 120.0° |
C1 | C3 | N9 | H17 | 75.6° | 0.0° |
C3 | N9 | C32 | H17 | 180.0° | 179.9° |
C3 | N9 | C32 | O34 | 11.2° | 0.1° |
C3 | N9 | C32 | C33 | 167.7° | 180.0° |
N9 | C3 | C1 | H14 | 2.2° | 55.0° |
N9 | C3 | H15 | H16 | 123.9° | 120.0° |
N9 | C32 | O34 | C33 | 178.7° | 179.9° |
C32 | N9 | C3 | H15 | 14.2° | 60.0° |
C32 | N9 | C3 | H16 | 137.0° | 60.0° |
N9 | C32 | C33 | H18 | 178.9° | 60.1° |
N9 | C32 | C33 | H19 | 61.2° | 179.9° |
N9 | C32 | C33 | H20 | 58.8° | 60.0° |
O34 | C32 | N9 | H17 | 168.8° | 180.0° |
O34 | C32 | C33 | H18 | 0.0° | 120.0° |
O34 | C32 | C33 | H19 | 120.0° | 0.0° |
O34 | C32 | C33 | H20 | 120.0° | 119.9° |
C33 | C32 | N9 | H17 | 12.3° | 0.1° |
C32 | C33 | H18 | H19 | 120.0° | 120.0° |
C32 | C33 | H18 | H20 | 120.0° | 120.0° |
C32 | C33 | H19 | H20 | 120.0° | 120.0° |
H2 | OP2 | P | OP3 | 146.1° | 60.0° |
H3 | C5' | C4' | H5 | 74.3° | 176.4° |
H4 | C5' | C4' | H5 | 44.1° | 63.6° |
H5 | C4' | C3' | H6 | 99.5° | 160.2° |
H6 | C3' | O3' | H7 | 53.3° | 56.4° |
H6 | C3' | C2' | H8 | 36.2° | 21.3° |
H6 | C3' | C2' | H9 | 86.3° | 144.0° |
H8 | C2' | C1' | H10 | 157.0° | 124.0° |
H9 | C2' | C1' | H10 | 34.6° | 1.3° |
H13 | C7 | C1 | H14 | 176.8° | 175.0° |
H14 | C1 | C3 | H15 | 116.4° | 65.0° |
H14 | C1 | C3 | H16 | 120.9° | 175.0° |
H15 | C3 | N9 | H17 | 165.8° | 119.9° |
H16 | C3 | N9 | H17 | 43.1° | 120.0° |
H18 | C33 | H19 | H20 | 120.0° | 120.0° |