C38
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O3P | P | sing | 1.61Å | 1.50Å | |
O3P | H3P | sing | 0.97Å | 0.95Å | |
P | O1P | doub | 1.48Å | 1.49Å | |
P | O2P | sing | 1.61Å | 1.60Å | |
P | O5' | sing | 1.61Å | 1.59Å | |
O2P | H2P | sing | 0.97Å | 0.95Å | |
O5' | C5' | sing | 1.43Å | 1.40Å | |
C5' | C4' | sing | 1.53Å | 1.51Å | |
C5' | H5'1 | sing | 1.09Å | 1.12Å | |
C5' | H5'2 | sing | 1.09Å | 1.12Å | |
C4' | O4' | sing | 1.45Å | 1.45Å | |
C4' | C3' | sing | 1.55Å | 1.52Å | |
C4' | H4' | sing | 1.09Å | 1.12Å | |
O4' | C1' | sing | 1.44Å | 1.40Å | |
C3' | O3' | sing | 1.43Å | 1.41Å | |
C3' | C2' | sing | 1.55Å | 1.52Å | |
C3' | H3' | sing | 1.09Å | 1.12Å | |
O3' | HA | sing | 0.97Å | 0.95Å | |
C2' | C1' | sing | 1.54Å | 1.51Å | |
C2' | H2'1 | sing | 1.09Å | 1.12Å | |
C2' | H2'2 | sing | 1.09Å | 1.12Å | |
C1' | N1 | sing | 1.46Å | 1.48Å | |
C1' | H1' | sing | 1.09Å | 1.12Å | |
N1 | C2 | sing | 1.35Å | 1.41Å | |
N1 | C6 | sing | 1.36Å | 1.38Å | |
C2 | O2 | doub | 1.22Å | 1.25Å | |
C2 | N3 | sing | 1.33Å | 1.34Å | |
N3 | C4 | doub | 1.33Å | 1.34Å | |
C4 | N4 | sing | 1.38Å | 1.35Å | |
C4 | C5 | sing | 1.41Å | 1.46Å | |
N4 | H4N1 | sing | 0.97Å | 1.02Å | |
N4 | H4N2 | sing | 0.97Å | 1.02Å | |
C5 | C6 | doub | 1.35Å | 1.35Å | |
C5 | I | sing | 2.09Å | 1.51Å | |
C6 | H6 | sing | 1.08Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
P | O3P | H3P | 121.0° | 106.8° |
O3P | P | O1P | 121.0° | 109.5° |
O3P | P | O2P | 111.3° | 109.5° |
O3P | P | O5' | 107.5° | 109.5° |
O1P | P | O2P | 101.6° | 109.5° |
O1P | P | O5' | 109.8° | 109.5° |
O2P | P | O5' | 104.4° | 109.5° |
P | O2P | H2P | 111.2° | 106.8° |
P | O5' | C5' | 119.7° | 106.8° |
O5' | C5' | C4' | 110.0° | 109.5° |
O5' | C5' | H5'1 | 112.1° | 109.4° |
O5' | C5' | H5'2 | 112.0° | 109.4° |
C4' | C5' | H5'1 | 112.0° | 109.5° |
C4' | C5' | H5'2 | 112.0° | 109.5° |
C5' | C4' | O4' | 111.7° | 110.8° |
C5' | C4' | C3' | 114.7° | 110.7° |
C5' | C4' | H4' | 108.2° | 110.6° |
H5'1 | C5' | H5'2 | 98.3° | 109.5° |
O4' | C4' | C3' | 105.7° | 103.6° |
O4' | C4' | H4' | 108.1° | 110.5° |
C4' | O4' | C1' | 108.0° | 106.9° |
C3' | C4' | H4' | 108.2° | 110.6° |
C4' | C3' | O3' | 107.9° | 111.0° |
C4' | C3' | C2' | 104.2° | 102.1° |
C4' | C3' | H3' | 112.1° | 110.9° |
O4' | C1' | C2' | 103.2° | 107.4° |
O4' | C1' | N1 | 108.6° | 109.9° |
O4' | C1' | H1' | 110.2° | 109.9° |
O3' | C3' | C2' | 108.0° | 110.9° |
O3' | C3' | H3' | 112.1° | 110.7° |
C3' | O3' | HA | 108.0° | 106.9° |
C2' | C3' | H3' | 112.1° | 110.9° |
C3' | C2' | C1' | 101.9° | 104.2° |
C3' | C2' | H2'1 | 115.1° | 110.5° |
C3' | C2' | H2'2 | 115.1° | 110.6° |
C1' | C2' | H2'1 | 115.1° | 110.5° |
C1' | C2' | H2'2 | 115.1° | 110.4° |
C2' | C1' | N1 | 114.2° | 109.9° |
C2' | C1' | H1' | 110.2° | 109.8° |
H2'1 | C2' | H2'2 | 95.4° | 110.5° |
N1 | C1' | H1' | 110.2° | 109.8° |
C1' | N1 | C2 | 118.1° | 119.8° |
C1' | N1 | C6 | 121.5° | 119.9° |
C2 | N1 | C6 | 120.3° | 120.3° |
N1 | C2 | O2 | 119.5° | 119.4° |
N1 | C2 | N3 | 119.5° | 121.1° |
N1 | C6 | C5 | 121.4° | 119.3° |
N1 | C6 | H6 | 120.3° | 120.3° |
O2 | C2 | N3 | 121.1° | 119.4° |
C2 | N3 | C4 | 120.6° | 120.7° |
N3 | C4 | N4 | 115.6° | 120.2° |
N3 | C4 | C5 | 121.8° | 119.6° |
N4 | C4 | C5 | 122.6° | 120.2° |
C4 | N4 | H4N1 | 115.6° | 120.0° |
C4 | N4 | H4N2 | 122.6° | 120.0° |
C4 | C5 | C6 | 116.3° | 118.9° |
C4 | C5 | I | 121.1° | 120.5° |
H4N1 | N4 | H4N2 | 121.8° | 120.0° |
C6 | C5 | I | 122.6° | 120.6° |
C5 | C6 | H6 | 118.2° | 120.3° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O3P | P | O1P | O2P | 123.8° | 120.0° |
O3P | P | O1P | O5' | 126.1° | 120.0° |
O3P | P | O2P | O5' | 115.6° | 120.0° |
O3P | P | O2P | H2P | 179.9° | 60.0° |
O3P | P | O5' | C5' | 164.6° | 180.0° |
H3P | O3P | P | O1P | 180.0° | 60.0° |
H3P | O3P | P | O2P | 60.8° | 60.0° |
H3P | O3P | P | O5' | 52.9° | 180.0° |
O1P | P | O2P | O5' | 114.2° | 120.0° |
O1P | P | O2P | H2P | 49.9° | 180.0° |
O1P | P | O5' | C5' | 61.9° | 60.0° |
O2P | P | O5' | C5' | 46.4° | 60.0° |
O5' | P | O2P | H2P | 64.3° | 60.0° |
P | O5' | C5' | C4' | 147.6° | 180.0° |
P | O5' | C5' | H5'1 | 22.4° | 60.0° |
P | O5' | C5' | H5'2 | 87.1° | 60.0° |
O5' | C5' | C4' | H5'1 | 125.3° | 120.0° |
O5' | C5' | C4' | H5'2 | 125.3° | 120.0° |
O5' | C5' | H5'1 | H5'2 | 117.9° | 119.9° |
O5' | C5' | C4' | O4' | 79.8° | 65.8° |
O5' | C5' | C4' | C3' | 40.5° | 180.0° |
O5' | C5' | C4' | H4' | 161.3° | 57.1° |
C4' | C5' | H5'1 | H5'2 | 117.9° | 120.1° |
C5' | C4' | O4' | C3' | 125.4° | 118.7° |
C5' | C4' | O4' | H4' | 118.9° | 122.9° |
C5' | C4' | C3' | H4' | 120.8° | 122.9° |
C5' | C4' | O4' | C1' | 146.0° | 158.5° |
C5' | C4' | C3' | O3' | 127.7° | 86.1° |
C5' | C4' | C3' | C2' | 117.7° | 155.6° |
C5' | C4' | C3' | H3' | 3.7° | 37.4° |
H5'1 | C5' | C4' | O4' | 45.6° | 174.3° |
H5'1 | C5' | C4' | C3' | 165.8° | 60.0° |
H5'1 | C5' | C4' | H4' | 73.4° | 62.9° |
H5'2 | C5' | C4' | O4' | 155.0° | 54.2° |
H5'2 | C5' | C4' | C3' | 84.8° | 60.0° |
H5'2 | C5' | C4' | H4' | 36.1° | 177.1° |
O4' | C4' | C3' | H4' | 115.6° | 118.4° |
O4' | C4' | C3' | O3' | 108.8° | 155.2° |
O4' | C4' | C3' | C2' | 5.9° | 36.9° |
O4' | C4' | C3' | H3' | 127.3° | 81.3° |
C4' | O4' | C1' | C2' | 38.6° | 26.3° |
C4' | O4' | C1' | N1 | 160.1° | 145.9° |
C4' | O4' | C1' | H1' | 79.1° | 93.1° |
C3' | C4' | O4' | C1' | 20.6° | 39.8° |
C4' | C3' | O3' | C2' | 112.1° | 112.8° |
C4' | C3' | O3' | H3' | 123.9° | 123.6° |
C4' | C3' | C2' | H3' | 121.4° | 118.2° |
C4' | C3' | O3' | HA | 180.0° | 174.2° |
C4' | C3' | C2' | C1' | 27.6° | 20.9° |
C4' | C3' | C2' | H2'1 | 152.9° | 97.9° |
C4' | C3' | C2' | H2'2 | 97.6° | 139.5° |
H4' | C4' | O4' | C1' | 95.0° | 78.6° |
H4' | C4' | C3' | O3' | 6.9° | 36.8° |
H4' | C4' | C3' | C2' | 121.5° | 81.5° |
H4' | C4' | C3' | H3' | 117.1° | 160.3° |
O4' | C1' | C2' | C3' | 40.7° | 2.0° |
O4' | C1' | C2' | N1 | 117.7° | 119.6° |
O4' | C1' | C2' | H1' | 117.7° | 119.5° |
O4' | C1' | C2' | H2'1 | 165.9° | 120.6° |
O4' | C1' | C2' | H2'2 | 84.6° | 116.8° |
O4' | C1' | N1 | H1' | 120.8° | 121.1° |
O4' | C1' | N1 | C2 | 111.7° | 58.3° |
O4' | C1' | N1 | C6 | 70.5° | 121.8° |
O3' | C3' | C2' | H3' | 124.0° | 123.5° |
O3' | C3' | C2' | C1' | 87.0° | 139.2° |
O3' | C3' | C2' | H2'1 | 38.3° | 20.5° |
O3' | C3' | C2' | H2'2 | 147.8° | 102.1° |
C2' | C3' | O3' | HA | 67.9° | 61.4° |
C3' | C2' | C1' | H2'1 | 125.3° | 118.7° |
C3' | C2' | C1' | H2'2 | 125.3° | 118.8° |
C3' | C2' | H2'1 | H2'2 | 121.0° | 122.7° |
C3' | C2' | C1' | N1 | 158.3° | 121.5° |
C3' | C2' | C1' | H1' | 77.0° | 117.6° |
H3' | C3' | O3' | HA | 56.1° | 62.2° |
H3' | C3' | C2' | C1' | 149.0° | 97.3° |
H3' | C3' | C2' | H2'1 | 85.7° | 144.0° |
H3' | C3' | C2' | H2'2 | 23.8° | 21.3° |
C1' | C2' | H2'1 | H2'2 | 121.0° | 122.5° |
C2' | C1' | N1 | H1' | 124.7° | 120.9° |
C2' | C1' | N1 | C2 | 133.8° | 59.7° |
C2' | C1' | N1 | C6 | 44.0° | 120.2° |
H2'1 | C2' | C1' | N1 | 76.4° | 119.8° |
H2'1 | C2' | C1' | H1' | 48.2° | 1.1° |
H2'2 | C2' | C1' | N1 | 33.1° | 2.8° |
H2'2 | C2' | C1' | H1' | 157.7° | 123.7° |
C1' | N1 | C2 | C6 | 177.9° | 179.9° |
C1' | N1 | C2 | O2 | 3.7° | 0.1° |
C1' | N1 | C2 | N3 | 176.0° | 180.0° |
C1' | N1 | C6 | C5 | 175.1° | 179.8° |
C1' | N1 | C6 | H6 | 4.9° | 0.1° |
H1' | C1' | N1 | C2 | 9.1° | 179.4° |
H1' | C1' | N1 | C6 | 168.7° | 0.7° |
N1 | C2 | O2 | N3 | 179.7° | 179.9° |
N1 | C2 | N3 | C4 | 0.2° | 0.2° |
C2 | N1 | C6 | C5 | 2.7° | 0.3° |
C2 | N1 | C6 | H6 | 177.4° | 180.0° |
C6 | N1 | C2 | O2 | 178.5° | 180.0° |
C6 | N1 | C2 | N3 | 1.9° | 0.1° |
N1 | C6 | C5 | C4 | 1.8° | 0.6° |
N1 | C6 | C5 | H6 | 179.9° | 179.7° |
N1 | C6 | C5 | I | 178.1° | 180.0° |
O2 | C2 | N3 | C4 | 179.9° | 179.9° |
C2 | N3 | C4 | N4 | 179.7° | 179.9° |
C2 | N3 | C4 | C5 | 0.6° | 0.4° |
N3 | C4 | N4 | C5 | 179.7° | 179.7° |
N3 | C4 | N4 | H4N1 | 180.0° | 0.0° |
N3 | C4 | N4 | H4N2 | 0.3° | 179.8° |
N3 | C4 | C5 | C6 | 0.2° | 0.6° |
N3 | C4 | C5 | I | 179.7° | 179.9° |
C4 | N4 | H4N1 | H4N2 | 179.7° | 179.8° |
N4 | C4 | C5 | C6 | 179.5° | 179.7° |
N4 | C4 | C5 | I | 0.6° | 0.3° |
C5 | C4 | N4 | H4N1 | 0.3° | 179.7° |
C5 | C4 | N4 | H4N2 | 180.0° | 0.5° |
C4 | C5 | C6 | I | 179.9° | 179.5° |
C4 | C5 | C6 | H6 | 178.2° | 179.7° |
I | C5 | C6 | H6 | 1.8° | 0.3° |