Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O1' | P | doub | 1.48Å | 1.60Å | |
O5' | P | sing | 1.61Å | 1.59Å | |
P | OP1 | sing | 1.61Å | 1.48Å | |
P | OP2 | sing | 1.61Å | 1.49Å | |
OP1 | HOP1 | sing | 0.97Å | 0.95Å | |
OP2 | HOP2 | sing | 0.97Å | 0.95Å | |
C5' | O5' | sing | 1.43Å | 1.43Å | |
C4' | C5' | sing | 1.53Å | 1.51Å | |
C5' | H5' | sing | 1.09Å | 1.10Å | |
C5' | H5'A | sing | 1.09Å | 1.10Å | |
O4' | C4' | sing | 1.44Å | 1.45Å | |
C4' | C3' | sing | 1.55Å | 1.53Å | |
C4' | H4' | sing | 1.09Å | 1.10Å | |
O4' | C1' | sing | 1.44Å | 1.42Å | |
C2' | C3' | sing | 1.55Å | 1.52Å | |
C3' | O3' | sing | 1.43Å | 1.43Å | |
C3' | H3' | sing | 1.09Å | 1.10Å | |
O3' | HO3' | sing | 0.97Å | 0.95Å | |
C1' | C2' | sing | 1.54Å | 1.52Å | |
C2' | H2' | sing | 1.09Å | 1.10Å | |
C2' | H2'A | sing | 1.09Å | 1.10Å | |
N1 | C1' | sing | 1.46Å | 1.49Å | |
C1' | H1' | sing | 1.09Å | 1.10Å | |
C2 | N1 | sing | 1.35Å | 1.38Å | |
N1 | C6 | sing | 1.37Å | 1.38Å | |
O2 | C2 | doub | 1.22Å | 1.22Å | |
N3 | C2 | sing | 1.35Å | 1.37Å | |
N3 | C4 | sing | 1.35Å | 1.38Å | |
N3 | HN3 | sing | 0.97Å | 1.00Å | |
O4 | C4 | doub | 1.22Å | 1.24Å | |
C4 | C5 | sing | 1.42Å | 1.45Å | |
C5 | C6 | doub | 1.35Å | 1.33Å | |
C5 | BR | sing | 1.89Å | 1.84Å | |
C6 | H6 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O1' | P | O5' | 100.4° | 109.4° |
O1' | P | OP1 | 108.6° | 109.5° |
O1' | P | OP2 | 110.8° | 109.5° |
O5' | P | OP1 | 107.1° | 109.5° |
O5' | P | OP2 | 109.5° | 109.5° |
P | O5' | C5' | 120.1° | 123.0° |
OP1 | P | OP2 | 118.8° | 109.5° |
P | OP1 | HOP1 | 109.5° | 114.0° |
P | OP2 | HOP2 | 109.5° | 114.0° |
O5' | C5' | C4' | 111.2° | 109.5° |
O5' | C5' | H5' | 108.9° | 109.5° |
O5' | C5' | H5'A | 108.5° | 109.4° |
C4' | C5' | H5' | 108.9° | 109.5° |
C4' | C5' | H5'A | 108.5° | 109.5° |
C5' | C4' | O4' | 110.9° | 110.4° |
C5' | C4' | C3' | 116.2° | 110.4° |
C5' | C4' | H4' | 102.7° | 110.3° |
H5' | C5' | H5'A | 110.8° | 109.4° |
O4' | C4' | C3' | 106.2° | 104.8° |
O4' | C4' | H4' | 113.4° | 110.5° |
C4' | O4' | C1' | 109.1° | 105.3° |
C3' | C4' | H4' | 107.7° | 110.4° |
C4' | C3' | C2' | 105.2° | 104.0° |
C4' | C3' | O3' | 119.0° | 110.5° |
C4' | C3' | H3' | 109.8° | 110.5° |
O4' | C1' | C2' | 105.3° | 104.8° |
O4' | C1' | N1 | 108.0° | 110.3° |
O4' | C1' | H1' | 114.4° | 110.3° |
C2' | C3' | O3' | 118.5° | 110.5° |
C2' | C3' | H3' | 110.5° | 110.6° |
C3' | C2' | C1' | 104.8° | 104.1° |
C3' | C2' | H2' | 111.0° | 110.5° |
C3' | C2' | H2'A | 112.0° | 110.5° |
O3' | C3' | H3' | 92.9° | 110.5° |
C3' | O3' | HO3' | 109.5° | 114.0° |
C1' | C2' | H2' | 111.0° | 110.5° |
C1' | C2' | H2'A | 112.1° | 110.6° |
C2' | C1' | N1 | 113.2° | 110.4° |
C2' | C1' | H1' | 109.3° | 110.4° |
H2' | C2' | H2'A | 106.0° | 110.5° |
N1 | C1' | H1' | 106.7° | 110.5° |
C1' | N1 | C2 | 119.3° | 119.7° |
C1' | N1 | C6 | 119.8° | 119.7° |
C2 | N1 | C6 | 120.9° | 120.6° |
N1 | C2 | O2 | 123.8° | 119.5° |
N1 | C2 | N3 | 114.4° | 121.0° |
N1 | C6 | C5 | 123.8° | 119.6° |
N1 | C6 | H6 | 118.1° | 120.2° |
O2 | C2 | N3 | 121.8° | 119.5° |
C2 | N3 | C4 | 127.7° | 120.2° |
C2 | N3 | HN3 | 116.1° | 119.9° |
C4 | N3 | HN3 | 116.2° | 119.9° |
N3 | C4 | O4 | 119.8° | 120.3° |
N3 | C4 | C5 | 114.6° | 119.4° |
O4 | C4 | C5 | 125.7° | 120.3° |
C4 | C5 | C6 | 118.5° | 119.1° |
C4 | C5 | BR | 118.8° | 120.5° |
C6 | C5 | BR | 122.7° | 120.4° |
C5 | C6 | H6 | 118.1° | 120.2° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O1' | P | O5' | OP1 | 113.3° | 120.0° |
O1' | P | O5' | OP2 | 116.6° | 120.0° |
O1' | P | OP1 | OP2 | 127.8° | 120.0° |
O1' | P | OP1 | HOP1 | 6.4° | 180.0° |
O1' | P | OP2 | HOP2 | 0.2° | 60.1° |
O1' | P | O5' | C5' | 53.1° | 55.0° |
O5' | P | OP1 | OP2 | 124.5° | 120.0° |
O5' | P | OP1 | HOP1 | 101.2° | 60.0° |
O5' | P | OP2 | HOP2 | 110.1° | 180.0° |
P | O5' | C5' | C4' | 165.9° | 180.0° |
P | O5' | C5' | H5' | 74.1° | 60.0° |
P | O5' | C5' | H5'A | 46.6° | 60.0° |
OP1 | P | OP2 | HOP2 | 126.5° | 60.0° |
OP1 | P | O5' | C5' | 60.2° | 65.0° |
OP2 | P | OP1 | HOP1 | 134.2° | 60.0° |
OP2 | P | O5' | C5' | 169.8° | 175.0° |
O5' | C5' | C4' | H5' | 120.0° | 120.0° |
O5' | C5' | C4' | H5'A | 119.3° | 120.0° |
O5' | C5' | H5' | H5'A | 119.3° | 119.9° |
O5' | C5' | C4' | O4' | 72.5° | 69.6° |
O5' | C5' | C4' | C3' | 48.8° | 175.0° |
O5' | C5' | C4' | H4' | 166.1° | 52.7° |
C4' | C5' | H5' | H5'A | 119.3° | 120.0° |
C5' | C4' | O4' | C3' | 127.1° | 118.8° |
C5' | C4' | O4' | H4' | 114.9° | 122.3° |
C5' | C4' | C3' | H4' | 114.4° | 122.2° |
C5' | C4' | O4' | C1' | 150.7° | 159.4° |
C5' | C4' | C3' | C2' | 129.4° | 142.8° |
C5' | C4' | C3' | O3' | 94.8° | 98.6° |
C5' | C4' | C3' | H3' | 10.4° | 24.1° |
H5' | C5' | C4' | O4' | 167.5° | 50.4° |
H5' | C5' | C4' | C3' | 71.2° | 65.0° |
H5' | C5' | C4' | H4' | 46.1° | 172.7° |
H5'A | C5' | C4' | O4' | 46.7° | 170.4° |
H5'A | C5' | C4' | C3' | 168.1° | 55.0° |
H5'A | C5' | C4' | H4' | 74.6° | 67.3° |
O4' | C4' | C3' | H4' | 121.7° | 118.9° |
O4' | C4' | C3' | C2' | 5.6° | 24.0° |
O4' | C4' | C3' | O3' | 141.4° | 142.6° |
O4' | C4' | C3' | H3' | 113.4° | 94.8° |
C4' | O4' | C1' | C2' | 31.8° | 40.6° |
C4' | O4' | C1' | N1 | 153.1° | 159.3° |
C4' | O4' | C1' | H1' | 88.3° | 78.3° |
C3' | C4' | O4' | C1' | 23.6° | 40.5° |
C4' | C3' | C2' | O3' | 136.1° | 118.6° |
C4' | C3' | C2' | H3' | 118.5° | 118.7° |
C4' | C3' | O3' | H3' | 114.7° | 122.6° |
C4' | C3' | O3' | HO3' | 147.6° | 180.0° |
C4' | C3' | C2' | C1' | 12.7° | 0.0° |
C4' | C3' | C2' | H2' | 107.3° | 118.6° |
C4' | C3' | C2' | H2'A | 134.4° | 118.8° |
H4' | C4' | O4' | C1' | 94.5° | 78.4° |
H4' | C4' | C3' | C2' | 116.2° | 95.0° |
H4' | C4' | C3' | O3' | 19.6° | 23.7° |
H4' | C4' | C3' | H3' | 124.8° | 146.3° |
O4' | C1' | C2' | C3' | 27.0° | 24.0° |
O4' | C1' | C2' | N1 | 117.8° | 118.8° |
O4' | C1' | C2' | H1' | 123.4° | 118.8° |
O4' | C1' | C2' | H2' | 93.0° | 94.7° |
O4' | C1' | C2' | H2'A | 148.7° | 142.7° |
O4' | C1' | N1 | H1' | 123.5° | 122.3° |
O4' | C1' | N1 | C2 | 125.9° | 53.8° |
O4' | C1' | N1 | C6 | 54.8° | 126.4° |
C2' | C3' | O3' | H3' | 115.3° | 122.8° |
C2' | C3' | O3' | HO3' | 82.3° | 65.4° |
C3' | C2' | C1' | H2' | 120.0° | 118.7° |
C3' | C2' | C1' | H2'A | 121.7° | 118.7° |
C3' | C2' | H2' | H2'A | 121.9° | 122.6° |
C3' | C2' | C1' | N1 | 144.8° | 142.8° |
C3' | C2' | C1' | H1' | 96.4° | 94.8° |
O3' | C3' | C2' | C1' | 123.4° | 118.6° |
O3' | C3' | C2' | H2' | 116.6° | 122.7° |
O3' | C3' | C2' | H2'A | 1.6° | 0.1° |
H3' | C3' | O3' | HO3' | 33.0° | 57.4° |
H3' | C3' | C2' | C1' | 131.2° | 118.7° |
H3' | C3' | C2' | H2' | 11.2° | 0.0° |
H3' | C3' | C2' | H2'A | 107.0° | 122.6° |
C1' | C2' | H2' | H2'A | 121.9° | 122.7° |
C2' | C1' | N1 | H1' | 120.3° | 122.4° |
C2' | C1' | N1 | C2 | 117.9° | 61.5° |
C2' | C1' | N1 | C6 | 61.4° | 118.2° |
H2' | C2' | C1' | N1 | 24.8° | 24.1° |
H2' | C2' | C1' | H1' | 143.6° | 146.5° |
H2'A | C2' | C1' | N1 | 93.5° | 98.6° |
H2'A | C2' | C1' | H1' | 25.3° | 23.9° |
C1' | N1 | C2 | C6 | 179.3° | 179.7° |
C1' | N1 | C2 | O2 | 2.3° | 0.1° |
C1' | N1 | C2 | N3 | 178.3° | 180.0° |
C1' | N1 | C6 | C5 | 177.7° | 179.8° |
C1' | N1 | C6 | H6 | 2.3° | 0.0° |
H1' | C1' | N1 | C2 | 2.4° | 176.1° |
H1' | C1' | N1 | C6 | 178.2° | 4.2° |
N1 | C2 | O2 | N3 | 179.4° | 179.9° |
N1 | C2 | N3 | C4 | 1.2° | 0.1° |
N1 | C2 | N3 | HN3 | 178.8° | 180.0° |
C2 | N1 | C6 | C5 | 1.6° | 0.5° |
C2 | N1 | C6 | H6 | 178.4° | 179.7° |
C6 | N1 | C2 | O2 | 178.4° | 179.8° |
C6 | N1 | C2 | N3 | 1.0° | 0.3° |
N1 | C6 | C5 | C4 | 2.0° | 0.5° |
N1 | C6 | C5 | H6 | 180.0° | 179.8° |
N1 | C6 | C5 | BR | 176.9° | 179.8° |
O2 | C2 | N3 | C4 | 178.3° | 180.0° |
O2 | C2 | N3 | HN3 | 1.8° | 0.0° |
C2 | N3 | C4 | HN3 | 180.0° | 180.0° |
C2 | N3 | C4 | O4 | 177.9° | 180.0° |
C2 | N3 | C4 | C5 | 1.5° | 0.1° |
N3 | C4 | O4 | C5 | 179.4° | 180.0° |
N3 | C4 | C5 | C6 | 1.8° | 0.3° |
N3 | C4 | C5 | BR | 177.1° | 180.0° |
HN3 | N3 | C4 | O4 | 2.1° | 0.0° |
HN3 | N3 | C4 | C5 | 178.4° | 180.0° |
O4 | C4 | C5 | C6 | 177.6° | 179.7° |
O4 | C4 | C5 | BR | 3.4° | 0.0° |
C4 | C5 | C6 | BR | 178.9° | 179.7° |
C4 | C5 | C6 | H6 | 178.0° | 179.7° |
BR | C5 | C6 | H6 | 3.1° | 0.0° |