DU
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
OP3 | P | sing | 1.62Å | 17.31Å | |
OP3 | HOP3 | sing | 0.98Å | 0.95Å | |
P | OP1 | doub | 1.50Å | 1.49Å | |
P | OP2 | sing | 1.62Å | 1.49Å | |
P | O5' | sing | 1.62Å | 1.60Å | |
OP2 | HOP2 | sing | 0.98Å | 0.95Å | |
O5' | C5' | sing | 1.42Å | 1.44Å | |
C5' | C4' | sing | 1.52Å | 1.51Å | |
C5' | H5' | sing | 1.09Å | 1.10Å | |
C5' | H5'' | sing | 1.09Å | 1.10Å | |
C4' | O4' | sing | 1.44Å | 1.45Å | |
C4' | C3' | sing | 1.52Å | 1.53Å | |
C4' | H4' | sing | 1.09Å | 1.10Å | |
O4' | C1' | sing | 1.43Å | 1.43Å | |
C3' | O3' | sing | 1.43Å | 1.42Å | |
C3' | C2' | sing | 1.51Å | 1.52Å | |
C3' | H3' | sing | 1.09Å | 1.10Å | |
O3' | HO3' | sing | 0.97Å | 0.95Å | |
C2' | C1' | sing | 1.52Å | 1.52Å | |
C2' | H2' | sing | 1.10Å | 1.10Å | |
C2' | H2'' | sing | 1.09Å | 1.10Å | |
C1' | N1 | sing | 1.43Å | 1.47Å | |
C1' | H1' | sing | 1.10Å | 1.10Å | |
N1 | C2 | sing | 1.41Å | 1.38Å | |
N1 | C6 | sing | 1.39Å | 1.37Å | |
C2 | O2 | doub | 1.23Å | 1.22Å | |
C2 | N3 | sing | 1.40Å | 1.38Å | |
N3 | C4 | sing | 1.39Å | 1.38Å | |
N3 | H3 | sing | 1.02Å | 1.00Å | |
C4 | O4 | doub | 1.23Å | 1.23Å | |
C4 | C5 | sing | 1.48Å | 1.43Å | |
C5 | C6 | doub | 1.34Å | 1.33Å | |
C5 | H5 | sing | 1.08Å | 1.08Å | |
C6 | H6 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
P | OP3 | HOP3 | 137.6° | 118.9° |
OP3 | P | OP1 | 137.6° | 115.3° |
OP3 | P | OP2 | 99.2° | 103.3° |
OP3 | P | O5' | 72.1° | 103.7° |
OP1 | P | OP2 | 119.4° | 115.0° |
OP1 | P | O5' | 107.7° | 115.0° |
OP2 | P | O5' | 108.8° | 102.9° |
P | OP2 | HOP2 | 109.5° | 118.9° |
P | O5' | C5' | 120.5° | 118.5° |
O5' | C5' | C4' | 110.6° | 108.9° |
O5' | C5' | H5' | 108.8° | 109.0° |
O5' | C5' | H5'' | 109.1° | 108.9° |
C4' | C5' | H5' | 108.9° | 110.3° |
C4' | C5' | H5'' | 109.1° | 110.3° |
C5' | C4' | O4' | 110.4° | 107.9° |
C5' | C4' | C3' | 116.7° | 112.9° |
C5' | C4' | H4' | 102.6° | 109.5° |
H5' | C5' | H5'' | 110.4° | 109.3° |
O4' | C4' | C3' | 106.0° | 106.2° |
O4' | C4' | H4' | 114.1° | 107.9° |
C4' | O4' | C1' | 110.2° | 109.3° |
C3' | C4' | H4' | 107.3° | 112.2° |
C4' | C3' | O3' | 107.4° | 109.9° |
C4' | C3' | C2' | 103.1° | 103.1° |
C4' | C3' | H3' | 114.9° | 113.5° |
O4' | C1' | C2' | 105.6° | 107.4° |
O4' | C1' | N1 | 107.5° | 109.3° |
O4' | C1' | H1' | 115.1° | 108.0° |
O3' | C3' | C2' | 109.9° | 109.7° |
O3' | C3' | H3' | 108.7° | 107.4° |
C3' | O3' | HO3' | 109.5° | 107.3° |
C2' | C3' | H3' | 112.7° | 113.2° |
C3' | C2' | C1' | 102.0° | 102.5° |
C3' | C2' | H2' | 113.6° | 109.7° |
C3' | C2' | H2'' | 112.0° | 114.1° |
C1' | C2' | H2' | 113.6° | 110.6° |
C1' | C2' | H2'' | 112.1° | 111.7° |
C2' | C1' | N1 | 114.6° | 112.8° |
C2' | C1' | H1' | 108.1° | 111.5° |
H2' | C2' | H2'' | 103.9° | 108.3° |
N1 | C1' | H1' | 106.2° | 107.8° |
C1' | N1 | C2 | 118.2° | 121.3° |
C1' | N1 | C6 | 120.8° | 118.4° |
C2 | N1 | C6 | 121.0° | 120.3° |
N1 | C2 | O2 | 122.8° | 123.8° |
N1 | C2 | N3 | 114.8° | 115.1° |
N1 | C6 | C5 | 122.8° | 123.9° |
N1 | C6 | H6 | 118.6° | 115.6° |
O2 | C2 | N3 | 122.4° | 121.1° |
C2 | N3 | C4 | 126.8° | 126.8° |
C2 | N3 | H3 | 116.6° | 116.6° |
C4 | N3 | H3 | 116.6° | 116.6° |
N3 | C4 | O4 | 119.5° | 124.5° |
N3 | C4 | C5 | 114.8° | 114.6° |
O4 | C4 | C5 | 125.7° | 120.9° |
C4 | C5 | C6 | 119.8° | 119.3° |
C4 | C5 | H5 | 120.1° | 118.8° |
C6 | C5 | H5 | 120.1° | 121.9° |
C5 | C6 | H6 | 118.6° | 120.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
OP3 | P | OP1 | OP2 | 152.9° | 120.1° |
OP3 | P | OP1 | O5' | 82.5° | 120.6° |
OP3 | P | OP2 | O5' | 74.1° | 107.7° |
OP3 | P | OP2 | HOP2 | 2.3° | 78.5° |
OP3 | P | O5' | C5' | 54.0° | 53.2° |
HOP3 | OP3 | P | OP1 | 180.0° | 48.8° |
HOP3 | OP3 | P | OP2 | 23.7° | 77.5° |
HOP3 | OP3 | P | O5' | 83.2° | 175.4° |
OP1 | P | OP2 | O5' | 124.0° | 125.8° |
OP1 | P | OP2 | HOP2 | 159.6° | 48.0° |
OP1 | P | O5' | C5' | 170.6° | 179.9° |
OP2 | P | O5' | C5' | 39.9° | 54.2° |
O5' | P | OP2 | HOP2 | 76.4° | 173.8° |
P | O5' | C5' | C4' | 151.5° | 180.0° |
P | O5' | C5' | H5' | 89.0° | 59.6° |
P | O5' | C5' | H5'' | 31.5° | 59.6° |
O5' | C5' | C4' | H5' | 119.5° | 119.6° |
O5' | C5' | C4' | H5'' | 120.0° | 119.5° |
O5' | C5' | H5' | H5'' | 119.7° | 119.0° |
O5' | C5' | C4' | O4' | 72.8° | 62.4° |
O5' | C5' | C4' | C3' | 48.3° | 179.5° |
O5' | C5' | C4' | H4' | 165.3° | 54.7° |
C4' | C5' | H5' | H5'' | 119.7° | 121.5° |
C5' | C4' | O4' | C3' | 127.2° | 121.4° |
C5' | C4' | O4' | H4' | 114.9° | 118.2° |
C5' | C4' | C3' | H4' | 114.4° | 124.3° |
C5' | C4' | O4' | C1' | 124.5° | 108.6° |
C5' | C4' | C3' | O3' | 144.5° | 154.2° |
C5' | C4' | C3' | C2' | 99.5° | 88.8° |
C5' | C4' | C3' | H3' | 23.5° | 34.0° |
H5' | C5' | C4' | O4' | 46.8° | 57.1° |
H5' | C5' | C4' | C3' | 167.8° | 60.0° |
H5' | C5' | C4' | H4' | 75.2° | 174.3° |
H5'' | C5' | C4' | O4' | 167.3° | 178.1° |
H5'' | C5' | C4' | C3' | 71.7° | 61.0° |
H5'' | C5' | C4' | H4' | 45.3° | 64.8° |
O4' | C4' | C3' | H4' | 122.2° | 117.6° |
O4' | C4' | C3' | O3' | 92.1° | 87.7° |
O4' | C4' | C3' | C2' | 23.9° | 29.2° |
O4' | C4' | C3' | H3' | 146.8° | 152.1° |
C4' | O4' | C1' | C2' | 19.8° | 9.0° |
C4' | O4' | C1' | N1 | 142.6° | 131.7° |
C4' | O4' | C1' | H1' | 99.3° | 111.3° |
C3' | C4' | O4' | C1' | 2.7° | 12.7° |
C4' | C3' | O3' | C2' | 111.4° | 112.7° |
C4' | C3' | O3' | H3' | 124.9° | 123.9° |
C4' | C3' | C2' | H3' | 124.5° | 123.0° |
C4' | C3' | O3' | HO3' | 128.8° | 128.0° |
C4' | C3' | C2' | C1' | 34.7° | 33.4° |
C4' | C3' | C2' | H2' | 157.3° | 84.1° |
C4' | C3' | C2' | H2'' | 85.3° | 154.3° |
H4' | C4' | O4' | C1' | 120.5° | 133.2° |
H4' | C4' | C3' | O3' | 30.1° | 29.9° |
H4' | C4' | C3' | C2' | 146.1° | 146.9° |
H4' | C4' | C3' | H3' | 91.0° | 90.3° |
O4' | C1' | C2' | C3' | 34.0° | 26.9° |
O4' | C1' | C2' | N1 | 118.1° | 120.5° |
O4' | C1' | C2' | H1' | 123.7° | 118.1° |
O4' | C1' | C2' | H2' | 156.7° | 90.0° |
O4' | C1' | C2' | H2'' | 86.0° | 149.4° |
O4' | C1' | N1 | H1' | 123.7° | 117.1° |
O4' | C1' | N1 | C2 | 118.4° | 147.1° |
O4' | C1' | N1 | C6 | 61.1° | 32.9° |
O3' | C3' | C2' | H3' | 121.4° | 119.9° |
O3' | C3' | C2' | C1' | 79.5° | 83.6° |
O3' | C3' | C2' | H2' | 43.1° | 158.9° |
O3' | C3' | C2' | H2'' | 160.5° | 37.2° |
C2' | C3' | O3' | HO3' | 119.8° | 119.3° |
C3' | C2' | C1' | H2' | 122.7° | 116.9° |
C3' | C2' | C1' | H2'' | 120.0° | 122.5° |
C3' | C2' | H2' | H2'' | 122.0° | 125.1° |
C3' | C2' | C1' | N1 | 152.1° | 147.4° |
C3' | C2' | C1' | H1' | 89.7° | 91.2° |
H3' | C3' | O3' | HO3' | 3.9° | 4.1° |
H3' | C3' | C2' | C1' | 159.1° | 156.4° |
H3' | C3' | C2' | H2' | 78.2° | 38.9° |
H3' | C3' | C2' | H2'' | 39.1° | 82.7° |
C1' | C2' | H2' | H2'' | 122.0° | 122.7° |
C2' | C1' | N1 | H1' | 119.2° | 123.5° |
C2' | C1' | N1 | C2 | 124.5° | 93.5° |
C2' | C1' | N1 | C6 | 56.0° | 86.5° |
H2' | C2' | C1' | N1 | 85.2° | 30.6° |
H2' | C2' | C1' | H1' | 33.0° | 151.9° |
H2'' | C2' | C1' | N1 | 32.2° | 90.1° |
H2'' | C2' | C1' | H1' | 150.4° | 31.3° |
C1' | N1 | C2 | C6 | 179.5° | 180.0° |
C1' | N1 | C2 | O2 | 1.0° | 0.0° |
C1' | N1 | C2 | N3 | 179.2° | 180.0° |
C1' | N1 | C6 | C5 | 179.3° | 180.0° |
C1' | N1 | C6 | H6 | 0.6° | 0.0° |
H1' | C1' | N1 | C2 | 5.2° | 30.0° |
H1' | C1' | N1 | C6 | 175.2° | 150.0° |
N1 | C2 | O2 | N3 | 179.8° | 180.0° |
N1 | C2 | N3 | C4 | 0.5° | 0.0° |
N1 | C2 | N3 | H3 | 179.5° | 180.0° |
C2 | N1 | C6 | C5 | 0.2° | 0.0° |
C2 | N1 | C6 | H6 | 179.8° | 180.0° |
C6 | N1 | C2 | O2 | 179.5° | 180.0° |
C6 | N1 | C2 | N3 | 0.4° | 0.0° |
N1 | C6 | C5 | C4 | 0.1° | 0.0° |
N1 | C6 | C5 | H6 | 180.0° | 180.0° |
N1 | C6 | C5 | H5 | 179.9° | 180.0° |
O2 | C2 | N3 | C4 | 179.3° | 180.0° |
O2 | C2 | N3 | H3 | 0.7° | 0.0° |
C2 | N3 | C4 | H3 | 180.0° | 180.0° |
C2 | N3 | C4 | O4 | 178.5° | 179.9° |
C2 | N3 | C4 | C5 | 0.4° | 0.0° |
N3 | C4 | O4 | C5 | 178.8° | 180.0° |
N3 | C4 | C5 | C6 | 0.2° | 0.0° |
N3 | C4 | C5 | H5 | 179.8° | 180.0° |
H3 | N3 | C4 | O4 | 1.5° | 0.0° |
H3 | N3 | C4 | C5 | 179.6° | 180.0° |
O4 | C4 | C5 | C6 | 178.7° | 180.0° |
O4 | C4 | C5 | H5 | 1.4° | 0.0° |
C4 | C5 | C6 | H5 | 180.0° | 180.0° |
C4 | C5 | C6 | H6 | 179.9° | 180.0° |
H5 | C5 | C6 | H6 | 0.1° | 0.0° |