FOX
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O1P | P | doub | 1.50Å | 1.50Å | |
P | O2P | sing | 1.62Å | 1.45Å | |
P | O5' | sing | 1.62Å | 1.61Å | |
P | O3P | sing | 1.62Å | 60.22Å | |
O2P | HOP2 | sing | 0.98Å | 0.95Å | |
O5' | C5' | sing | 1.42Å | 1.42Å | |
C5' | C4' | sing | 1.52Å | 1.53Å | |
C5' | H5'1 | sing | 1.09Å | 1.11Å | |
C5' | H5'2 | sing | 1.09Å | 1.11Å | |
C4' | C6' | sing | 1.53Å | 1.53Å | |
C4' | C3' | sing | 1.53Å | 1.55Å | |
C4' | H4' | sing | 1.10Å | 1.12Å | |
C6' | C1' | sing | 1.54Å | 1.54Å | |
C6' | H6'1 | sing | 1.10Å | 1.11Å | |
C6' | H6'2 | sing | 1.10Å | 1.11Å | |
C3' | O3' | sing | 1.41Å | 1.45Å | |
C3' | C2' | sing | 1.52Å | 1.51Å | |
C3' | H3' | sing | 1.10Å | 1.12Å | |
O3' | H3T | sing | 0.97Å | 0.95Å | |
C2' | C1' | sing | 1.53Å | 1.54Å | |
C2' | H2'1 | sing | 1.10Å | 1.11Å | |
C2' | H2'2 | sing | 1.10Å | 1.11Å | |
C1' | N9 | sing | 1.44Å | 1.48Å | |
C1' | H1' | sing | 1.09Å | 1.11Å | |
N9 | C4 | sing | 1.33Å | 1.40Å | |
N9 | H9 | sing | 1.02Å | 1.02Å | |
C4 | N3 | sing | 1.38Å | 1.37Å | |
C4 | C5 | doub | 1.35Å | 1.40Å | |
N3 | C2 | sing | 1.37Å | 1.33Å | |
N3 | H3 | sing | 1.01Å | 1.02Å | |
C2 | N2 | sing | 1.37Å | 1.33Å | |
C2 | N1 | doub | 1.31Å | 1.36Å | |
N2 | H21 | sing | 0.99Å | 1.02Å | |
N2 | H22 | sing | 0.99Å | 1.02Å | |
N1 | C6 | sing | 1.38Å | 1.38Å | |
C6 | O6 | doub | 1.23Å | 1.25Å | |
C6 | C5 | sing | 1.51Å | 1.42Å | |
C5 | N7 | sing | 1.37Å | 1.35Å | |
N7 | C8 | sing | 1.38Å | 1.34Å | |
N7 | H7 | sing | 1.01Å | 1.02Å | |
C8 | O8 | doub | 1.22Å | 1.26Å | |
C8 | H8 | sing | 1.10Å | 1.10Å | |
O3P | HOP3 | sing | 0.98Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O1P | P | O2P | 119.3° | 115.3° |
O1P | P | O5' | 108.5° | 115.0° |
O1P | P | O3P | 138.5° | 115.0° |
O2P | P | O5' | 109.1° | 103.8° |
O2P | P | O3P | 32.8° | 103.3° |
P | O2P | HOP2 | 119.4° | 119.0° |
O5' | P | O3P | 76.8° | 102.9° |
P | O5' | C5' | 121.1° | 118.5° |
P | O3P | HOP3 | 138.5° | 118.9° |
O5' | C5' | C4' | 110.2° | 108.7° |
O5' | C5' | H5'1 | 111.9° | 109.1° |
O5' | C5' | H5'2 | 111.9° | 109.1° |
C4' | C5' | H5'1 | 111.9° | 110.2° |
C4' | C5' | H5'2 | 111.9° | 110.2° |
C5' | C4' | C6' | 107.7° | 113.2° |
C5' | C4' | C3' | 111.3° | 113.1° |
C5' | C4' | H4' | 108.0° | 107.4° |
H5'1 | C5' | H5'2 | 98.5° | 109.5° |
C6' | C4' | C3' | 104.7° | 104.1° |
C6' | C4' | H4' | 114.3° | 109.4° |
C4' | C6' | C1' | 107.6° | 106.1° |
C4' | C6' | H6'1 | 112.9° | 109.7° |
C4' | C6' | H6'2 | 112.9° | 111.5° |
C3' | C4' | H4' | 110.8° | 109.5° |
C4' | C3' | O3' | 109.4° | 111.1° |
C4' | C3' | C2' | 102.7° | 102.4° |
C4' | C3' | H3' | 113.4° | 111.6° |
C1' | C6' | H6'1 | 112.9° | 110.7° |
C1' | C6' | H6'2 | 113.0° | 111.7° |
C6' | C1' | C2' | 104.2° | 105.7° |
C6' | C1' | N9 | 108.4° | 110.9° |
C6' | C1' | H1' | 114.6° | 110.8° |
H6'1 | C6' | H6'2 | 97.5° | 107.1° |
O3' | C3' | C2' | 108.4° | 111.5° |
O3' | C3' | H3' | 108.2° | 108.9° |
C3' | O3' | H3T | 109.4° | 107.1° |
C2' | C3' | H3' | 114.4° | 111.1° |
C3' | C2' | C1' | 104.7° | 103.8° |
C3' | C2' | H2'1 | 114.0° | 110.0° |
C3' | C2' | H2'2 | 114.0° | 111.8° |
C1' | C2' | H2'1 | 114.1° | 110.5° |
C1' | C2' | H2'2 | 114.1° | 113.7° |
C2' | C1' | N9 | 112.5° | 111.2° |
C2' | C1' | H1' | 110.6° | 110.3° |
H2'1 | C2' | H2'2 | 96.5° | 107.1° |
N9 | C1' | H1' | 106.7° | 108.0° |
C1' | N9 | C4 | 122.1° | 122.5° |
C1' | N9 | H9 | 107.6° | 119.4° |
C4 | N9 | H9 | 107.7° | 118.0° |
N9 | C4 | N3 | 118.4° | 120.3° |
N9 | C4 | C5 | 122.5° | 122.7° |
N3 | C4 | C5 | 118.8° | 117.0° |
C4 | N3 | C2 | 122.3° | 122.4° |
C4 | N3 | H3 | 107.6° | 116.4° |
C4 | C5 | C6 | 118.5° | 120.1° |
C4 | C5 | N7 | 122.3° | 123.5° |
C2 | N3 | H3 | 107.7° | 121.2° |
N3 | C2 | N2 | 119.9° | 113.8° |
N3 | C2 | N1 | 121.0° | 123.3° |
N2 | C2 | N1 | 119.1° | 122.9° |
C2 | N2 | H21 | 119.9° | 118.3° |
C2 | N2 | H22 | 108.5° | 118.3° |
C2 | N1 | C6 | 120.3° | 119.4° |
H21 | N2 | H22 | 108.5° | 123.4° |
N1 | C6 | O6 | 118.7° | 122.6° |
N1 | C6 | C5 | 118.9° | 117.8° |
O6 | C6 | C5 | 122.3° | 119.6° |
C6 | C5 | N7 | 119.2° | 116.4° |
C5 | N7 | C8 | 120.7° | 123.6° |
C5 | N7 | H7 | 119.9° | 118.2° |
C8 | N7 | H7 | 119.3° | 118.2° |
N7 | C8 | O8 | 120.2° | 128.4° |
N7 | C8 | H8 | 123.2° | 110.3° |
O8 | C8 | H8 | 116.5° | 121.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O1P | P | O2P | O5' | 125.5° | 126.7° |
O1P | P | O2P | O3P | 135.6° | 126.2° |
O1P | P | O5' | O3P | 137.1° | 125.8° |
O1P | P | O2P | HOP2 | 180.0° | 48.7° |
O1P | P | O5' | C5' | 58.3° | 180.0° |
O1P | P | O3P | HOP3 | 180.0° | 48.0° |
O2P | P | O5' | O3P | 5.6° | 107.4° |
O2P | P | O5' | C5' | 170.2° | 53.2° |
O2P | P | O3P | HOP3 | 113.0° | 78.4° |
O5' | P | O2P | HOP2 | 54.5° | 175.4° |
P | O5' | C5' | C4' | 165.2° | 180.0° |
P | O5' | C5' | H5'1 | 40.0° | 59.8° |
P | O5' | C5' | H5'2 | 69.5° | 59.8° |
O5' | P | O3P | HOP3 | 76.8° | 173.8° |
O3P | P | O2P | HOP2 | 44.4° | 77.5° |
O3P | P | O5' | C5' | 164.6° | 54.2° |
O5' | C5' | C4' | H5'1 | 125.2° | 119.5° |
O5' | C5' | C4' | H5'2 | 125.3° | 119.5° |
O5' | C5' | H5'1 | H5'2 | 117.8° | 119.4° |
O5' | C5' | C4' | C6' | 175.6° | 59.6° |
O5' | C5' | C4' | C3' | 61.3° | 177.7° |
O5' | C5' | C4' | H4' | 60.5° | 61.4° |
C4' | C5' | H5'1 | H5'2 | 117.9° | 121.4° |
C5' | C4' | C6' | C3' | 118.6° | 123.2° |
C5' | C4' | C6' | H4' | 120.0° | 119.8° |
C5' | C4' | C3' | H4' | 120.2° | 119.8° |
C5' | C4' | C6' | C1' | 104.1° | 145.4° |
C5' | C4' | C6' | H6'1 | 130.6° | 95.0° |
C5' | C4' | C6' | H6'2 | 21.2° | 23.5° |
C5' | C4' | C3' | O3' | 162.8° | 78.2° |
C5' | C4' | C3' | C2' | 82.2° | 162.5° |
C5' | C4' | C3' | H3' | 41.8° | 43.5° |
H5'1 | C5' | C4' | C6' | 59.2° | 59.9° |
H5'1 | C5' | C4' | C3' | 173.4° | 58.2° |
H5'1 | C5' | C4' | H4' | 64.7° | 179.1° |
H5'2 | C5' | C4' | C6' | 50.3° | 179.1° |
H5'2 | C5' | C4' | C3' | 63.9° | 62.8° |
H5'2 | C5' | C4' | H4' | 174.3° | 58.2° |
C6' | C4' | C3' | H4' | 123.7° | 116.9° |
C4' | C6' | C1' | H6'1 | 125.2° | 119.0° |
C4' | C6' | C1' | H6'2 | 125.3° | 121.7° |
C4' | C6' | H6'1 | H6'2 | 118.8° | 121.2° |
C6' | C4' | C3' | O3' | 81.1° | 158.5° |
C6' | C4' | C3' | C2' | 33.9° | 39.2° |
C6' | C4' | C3' | H3' | 157.9° | 79.8° |
C4' | C6' | C1' | C2' | 10.2° | 3.4° |
C4' | C6' | C1' | N9 | 130.2° | 117.3° |
C4' | C6' | C1' | H1' | 110.9° | 122.9° |
C3' | C4' | C6' | C1' | 14.5° | 22.1° |
C3' | C4' | C6' | H6'1 | 110.8° | 141.8° |
C3' | C4' | C6' | H6'2 | 139.8° | 99.7° |
C4' | C3' | O3' | C2' | 111.3° | 113.6° |
C4' | C3' | O3' | H3' | 124.1° | 123.4° |
C4' | C3' | C2' | H3' | 123.4° | 119.4° |
C4' | C3' | O3' | H3T | 179.9° | 140.7° |
C4' | C3' | C2' | C1' | 40.7° | 41.5° |
C4' | C3' | C2' | H2'1 | 84.6° | 76.8° |
C4' | C3' | C2' | H2'2 | 166.0° | 164.4° |
H4' | C4' | C6' | C1' | 135.9° | 94.8° |
H4' | C4' | C6' | H6'1 | 10.6° | 24.8° |
H4' | C4' | C6' | H6'2 | 98.8° | 143.3° |
H4' | C4' | C3' | O3' | 42.6° | 41.5° |
H4' | C4' | C3' | C2' | 157.6° | 77.7° |
H4' | C4' | C3' | H3' | 78.4° | 163.3° |
C1' | C6' | H6'1 | H6'2 | 118.9° | 122.0° |
C6' | C1' | C2' | C3' | 31.7° | 27.8° |
C6' | C1' | C2' | N9 | 117.2° | 120.4° |
C6' | C1' | C2' | H1' | 123.6° | 119.8° |
C6' | C1' | C2' | H2'1 | 93.5° | 90.1° |
C6' | C1' | C2' | H2'2 | 156.9° | 149.4° |
C6' | C1' | N9 | H1' | 123.9° | 121.5° |
C6' | C1' | N9 | C4 | 64.6° | 81.5° |
C6' | C1' | N9 | H9 | 170.2° | 98.5° |
H6'1 | C6' | C1' | C2' | 135.4° | 115.6° |
H6'1 | C6' | C1' | N9 | 104.6° | 123.7° |
H6'1 | C6' | C1' | H1' | 14.4° | 3.9° |
H6'2 | C6' | C1' | C2' | 115.1° | 125.1° |
H6'2 | C6' | C1' | N9 | 4.9° | 4.4° |
H6'2 | C6' | C1' | H1' | 123.9° | 115.4° |
O3' | C3' | C2' | H3' | 120.8° | 121.7° |
O3' | C3' | C2' | C1' | 75.1° | 160.4° |
O3' | C3' | C2' | H2'1 | 159.7° | 42.2° |
O3' | C3' | C2' | H2'2 | 50.2° | 76.6° |
C2' | C3' | O3' | H3T | 68.7° | 27.0° |
C3' | C2' | C1' | H2'1 | 125.2° | 117.9° |
C3' | C2' | C1' | H2'2 | 125.2° | 121.7° |
C3' | C2' | H2'1 | H2'2 | 119.9° | 121.6° |
C3' | C2' | C1' | N9 | 148.9° | 92.7° |
C3' | C2' | C1' | H1' | 91.9° | 147.6° |
H3' | C3' | O3' | H3T | 55.9° | 96.0° |
H3' | C3' | C2' | C1' | 164.1° | 77.9° |
H3' | C3' | C2' | H2'1 | 38.8° | 163.9° |
H3' | C3' | C2' | H2'2 | 70.6° | 45.1° |
C1' | C2' | H2'1 | H2'2 | 120.0° | 124.3° |
C2' | C1' | N9 | H1' | 121.5° | 121.2° |
C2' | C1' | N9 | C4 | 179.2° | 161.1° |
C2' | C1' | N9 | H9 | 55.5° | 18.8° |
H2'1 | C2' | C1' | N9 | 23.7° | 149.4° |
H2'1 | C2' | C1' | H1' | 142.9° | 29.7° |
H2'2 | C2' | C1' | N9 | 85.9° | 29.0° |
H2'2 | C2' | C1' | H1' | 33.3° | 90.8° |
C1' | N9 | C4 | H9 | 125.2° | 180.0° |
C1' | N9 | C4 | N3 | 9.9° | 0.1° |
C1' | N9 | C4 | C5 | 175.4° | 179.9° |
H1' | C1' | N9 | C4 | 59.3° | 40.0° |
H1' | C1' | N9 | H9 | 66.0° | 140.0° |
N9 | C4 | N3 | C5 | 174.9° | 180.0° |
N9 | C4 | N3 | C2 | 176.7° | 180.0° |
N9 | C4 | N3 | H3 | 58.0° | 0.0° |
N9 | C4 | C5 | C6 | 175.5° | 180.0° |
N9 | C4 | C5 | N7 | 7.4° | 0.0° |
H9 | N9 | C4 | N3 | 115.3° | 179.9° |
H9 | N9 | C4 | C5 | 59.3° | 0.1° |
C4 | N3 | C2 | H3 | 125.3° | 180.0° |
C4 | N3 | C2 | N2 | 179.8° | 180.0° |
C4 | N3 | C2 | N1 | 2.2° | 0.0° |
N3 | C4 | C5 | C6 | 0.9° | 0.0° |
N3 | C4 | C5 | N7 | 177.9° | 180.0° |
C5 | C4 | N3 | C2 | 1.8° | 0.0° |
C5 | C4 | N3 | H3 | 127.1° | 180.0° |
C4 | C5 | C6 | N1 | 0.4° | 0.0° |
C4 | C5 | C6 | O6 | 179.9° | 179.8° |
C4 | C5 | C6 | N7 | 177.1° | 179.9° |
C4 | C5 | N7 | C8 | 90.9° | 150.0° |
C4 | C5 | N7 | H7 | 89.1° | 30.0° |
N3 | C2 | N2 | N1 | 178.1° | 180.0° |
N3 | C2 | N2 | H21 | 180.0° | 18.1° |
N3 | C2 | N2 | H22 | 54.7° | 161.9° |
N3 | C2 | N1 | C6 | 1.6° | 0.0° |
H3 | N3 | C2 | N2 | 54.5° | 0.0° |
H3 | N3 | C2 | N1 | 127.5° | 180.0° |
C2 | N2 | H21 | H22 | 125.3° | 180.0° |
N2 | C2 | N1 | C6 | 179.7° | 180.0° |
N1 | C2 | N2 | H21 | 1.9° | 161.9° |
N1 | C2 | N2 | H22 | 127.2° | 18.1° |
C2 | N1 | C6 | O6 | 179.5° | 179.8° |
C2 | N1 | C6 | C5 | 0.7° | 0.0° |
N1 | C6 | O6 | C5 | 179.7° | 179.8° |
N1 | C6 | C5 | N7 | 177.5° | 180.0° |
O6 | C6 | C5 | N7 | 2.8° | 0.1° |
C6 | C5 | N7 | C8 | 86.1° | 30.0° |
C6 | C5 | N7 | H7 | 93.9° | 150.0° |
C5 | N7 | C8 | H7 | 180.0° | 180.0° |
C5 | N7 | C8 | O8 | 33.3° | 180.0° |
C5 | N7 | C8 | H8 | 146.8° | 0.0° |
N7 | C8 | O8 | H8 | 180.0° | 180.0° |
H7 | N7 | C8 | O8 | 146.7° | 0.0° |
H7 | N7 | C8 | H8 | 33.3° | 180.0° |