GX1
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
OP2 | P | doub | 1.48Å | 1.60Å | |
O5' | P | sing | 1.61Å | 1.59Å | |
P | OP1 | sing | 1.61Å | 1.48Å | |
P | N4 | sing | 1.68Å | 1.63Å | |
S | C8' | sing | 1.81Å | 1.83Å | |
S | HS | sing | 1.34Å | 1.30Å | |
C2 | N1 | sing | 1.36Å | 1.40Å | |
N1 | C6 | sing | 1.35Å | 1.39Å | |
N1 | HN1 | sing | 0.97Å | 1.00Å | |
N2 | C2 | sing | 1.37Å | 1.33Å | |
N3 | C2 | doub | 1.31Å | 1.34Å | |
N2 | HN2 | sing | 0.97Å | 1.00Å | |
N2 | HN2A | sing | 0.97Å | 1.00Å | |
N3 | C4 | sing | 1.34Å | 1.34Å | |
N9 | C4 | sing | 1.37Å | 1.33Å | Aromatic |
C4 | C5 | doub | 1.40Å | 1.39Å | Aromatic |
N4 | C7' | sing | 1.47Å | 1.47Å | |
N4 | HN4 | sing | 1.01Å | 1.00Å | |
C5 | C6 | sing | 1.41Å | 1.39Å | |
C5 | N7 | sing | 1.36Å | 1.33Å | Aromatic |
C6 | O6 | doub | 1.22Å | 1.23Å | |
C8 | N7 | doub | 1.30Å | 1.33Å | Aromatic |
N9 | C8 | sing | 1.36Å | 1.34Å | Aromatic |
C8 | H8 | sing | 1.08Å | 1.08Å | |
C1' | N9 | sing | 1.47Å | 1.49Å | |
C2' | C1' | sing | 1.55Å | 1.54Å | |
C1' | O4' | sing | 1.44Å | 1.46Å | |
C1' | H1' | sing | 1.09Å | 1.10Å | |
C2' | C3' | sing | 1.55Å | 1.52Å | |
C2' | H2' | sing | 1.09Å | 1.10Å | |
C2' | H2'A | sing | 1.09Å | 1.10Å | |
O3' | C3' | sing | 1.43Å | 1.43Å | |
C3' | C4' | sing | 1.55Å | 1.53Å | |
C3' | H3' | sing | 1.09Å | 1.10Å | |
O3' | HO3' | sing | 0.97Å | 0.95Å | |
O4' | C4' | sing | 1.45Å | 1.44Å | |
C4' | C5' | sing | 1.53Å | 1.52Å | |
C4' | H4' | sing | 1.09Å | 1.10Å | |
C5' | O5' | sing | 1.43Å | 1.41Å | |
C5' | H5' | sing | 1.09Å | 1.10Å | |
C5' | H5'A | sing | 1.09Å | 1.10Å | |
C8' | C7' | sing | 1.53Å | 1.53Å | |
C7' | H7' | sing | 1.09Å | 1.10Å | |
C7' | H7'A | sing | 1.09Å | 1.10Å | |
C8' | H8' | sing | 1.09Å | 1.10Å | |
C8' | H8'A | sing | 1.09Å | 1.10Å | |
OP1 | HOP1 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
OP2 | P | O5' | 102.1° | 109.5° |
OP2 | P | OP1 | 107.4° | 109.5° |
OP2 | P | N4 | 119.3° | 109.5° |
O5' | P | OP1 | 107.5° | 109.5° |
O5' | P | N4 | 109.2° | 109.5° |
P | O5' | C5' | 115.8° | 123.0° |
OP1 | P | N4 | 110.4° | 109.5° |
P | OP1 | HOP1 | 109.5° | 114.0° |
P | N4 | C7' | 121.7° | 111.0° |
P | N4 | HN4 | 105.6° | 111.0° |
C8' | S | HS | 102.0° | 103.0° |
S | C8' | C7' | 113.5° | 109.5° |
S | C8' | H8' | 108.2° | 109.5° |
S | C8' | H8'A | 108.2° | 109.5° |
C2 | N1 | C6 | 119.1° | 120.3° |
C2 | N1 | HN1 | 120.4° | 119.9° |
N1 | C2 | N2 | 119.3° | 119.0° |
N1 | C2 | N3 | 120.9° | 122.0° |
C6 | N1 | HN1 | 120.5° | 119.8° |
N1 | C6 | C5 | 118.6° | 118.3° |
N1 | C6 | O6 | 120.3° | 120.8° |
N2 | C2 | N3 | 119.8° | 119.1° |
C2 | N2 | HN2 | 120.0° | 120.1° |
C2 | N2 | HN2A | 120.0° | 120.0° |
C2 | N3 | C4 | 121.1° | 121.1° |
HN2 | N2 | HN2A | 120.0° | 119.9° |
N3 | C4 | N9 | 132.4° | 134.2° |
N3 | C4 | C5 | 120.3° | 119.7° |
N9 | C4 | C5 | 107.3° | 106.1° |
C4 | N9 | C8 | 107.7° | 107.5° |
C4 | N9 | C1' | 125.9° | 126.2° |
C4 | C5 | C6 | 120.1° | 118.6° |
C4 | C5 | N7 | 107.3° | 107.3° |
C7' | N4 | HN4 | 105.6° | 111.0° |
N4 | C7' | C8' | 110.1° | 109.5° |
N4 | C7' | H7' | 109.2° | 109.5° |
N4 | C7' | H7'A | 109.2° | 109.5° |
C6 | C5 | N7 | 132.6° | 134.1° |
C5 | C6 | O6 | 121.1° | 120.9° |
C5 | N7 | C8 | 108.0° | 109.3° |
N7 | C8 | N9 | 109.8° | 109.8° |
N7 | C8 | H8 | 125.1° | 125.1° |
N9 | C8 | H8 | 125.1° | 125.1° |
C8 | N9 | C1' | 126.3° | 126.3° |
N9 | C1' | C2' | 108.0° | 110.4° |
N9 | C1' | O4' | 113.3° | 110.4° |
N9 | C1' | H1' | 106.8° | 110.4° |
C2' | C1' | O4' | 105.9° | 104.8° |
C2' | C1' | H1' | 114.1° | 110.5° |
C1' | C2' | C3' | 104.4° | 104.1° |
C1' | C2' | H2' | 111.2° | 110.5° |
C1' | C2' | H2'A | 111.2° | 110.6° |
O4' | C1' | H1' | 108.9° | 110.4° |
C1' | O4' | C4' | 105.8° | 105.3° |
C3' | C2' | H2' | 111.2° | 110.5° |
C3' | C2' | H2'A | 111.2° | 110.5° |
C2' | C3' | O3' | 108.2° | 110.5° |
C2' | C3' | C4' | 102.7° | 104.0° |
C2' | C3' | H3' | 114.6° | 110.5° |
H2' | C2' | H2'A | 107.7° | 110.5° |
O3' | C3' | C4' | 109.6° | 110.5° |
O3' | C3' | H3' | 108.3° | 110.6° |
C3' | O3' | HO3' | 109.5° | 114.0° |
C4' | C3' | H3' | 113.3° | 110.5° |
C3' | C4' | O4' | 102.9° | 104.8° |
C3' | C4' | C5' | 113.9° | 110.4° |
C3' | C4' | H4' | 109.5° | 110.4° |
O4' | C4' | C5' | 104.3° | 110.4° |
O4' | C4' | H4' | 118.3° | 110.4° |
C5' | C4' | H4' | 108.1° | 110.3° |
C4' | C5' | O5' | 114.0° | 109.5° |
C4' | C5' | H5' | 108.0° | 109.5° |
C4' | C5' | H5'A | 108.0° | 109.5° |
O5' | C5' | H5' | 108.0° | 109.5° |
O5' | C5' | H5'A | 108.0° | 109.5° |
H5' | C5' | H5'A | 110.9° | 109.4° |
C8' | C7' | H7' | 109.3° | 109.4° |
C8' | C7' | H7'A | 109.2° | 109.4° |
C7' | C8' | H8' | 108.2° | 109.4° |
C7' | C8' | H8'A | 108.1° | 109.4° |
H7' | C7' | H7'A | 109.7° | 109.4° |
H8' | C8' | H8'A | 110.8° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
OP2 | P | O5' | OP1 | 112.9° | 120.0° |
OP2 | P | O5' | N4 | 127.3° | 120.0° |
OP2 | P | OP1 | N4 | 131.7° | 120.0° |
OP2 | P | N4 | C7' | 127.1° | 180.0° |
OP2 | P | N4 | HN4 | 113.0° | 56.1° |
OP2 | P | O5' | C5' | 56.5° | 50.0° |
OP2 | P | OP1 | HOP1 | 0.0° | 180.0° |
O5' | P | OP1 | N4 | 119.1° | 120.0° |
O5' | P | N4 | C7' | 116.1° | 60.0° |
O5' | P | N4 | HN4 | 3.9° | 63.9° |
P | O5' | C5' | C4' | 172.0° | 180.0° |
P | O5' | C5' | H5' | 68.0° | 60.0° |
P | O5' | C5' | H5'A | 52.0° | 60.0° |
O5' | P | OP1 | HOP1 | 109.3° | 60.0° |
OP1 | P | N4 | C7' | 1.9° | 60.0° |
OP1 | P | N4 | HN4 | 121.9° | 176.1° |
OP1 | P | O5' | C5' | 56.3° | 170.0° |
P | N4 | C7' | HN4 | 120.0° | 124.0° |
N4 | P | O5' | C5' | 176.2° | 70.0° |
P | N4 | C7' | C8' | 74.7° | 135.0° |
P | N4 | C7' | H7' | 165.3° | 105.0° |
P | N4 | C7' | H7'A | 45.3° | 15.0° |
N4 | P | OP1 | HOP1 | 131.6° | 60.0° |
S | C8' | C7' | N4 | 31.6° | 180.0° |
S | C8' | C7' | H8' | 120.0° | 120.0° |
S | C8' | C7' | H8'A | 120.0° | 120.1° |
S | C8' | C7' | H7' | 88.4° | 59.9° |
S | C8' | C7' | H7'A | 151.6° | 60.0° |
S | C8' | H8' | H8'A | 118.4° | 120.1° |
HS | S | C8' | C7' | 180.0° | 180.0° |
HS | S | C8' | H8' | 60.0° | 60.0° |
HS | S | C8' | H8'A | 60.0° | 60.0° |
C2 | N1 | C6 | HN1 | 180.0° | 179.8° |
N1 | C2 | N2 | N3 | 179.9° | 180.0° |
N1 | C2 | N2 | HN2 | 179.9° | 0.0° |
N1 | C2 | N2 | HN2A | 0.1° | 180.0° |
N1 | C2 | N3 | C4 | 0.1° | 0.0° |
C2 | N1 | C6 | C5 | 0.1° | 0.0° |
C2 | N1 | C6 | O6 | 180.0° | 179.7° |
C6 | N1 | C2 | N2 | 179.9° | 180.0° |
C6 | N1 | C2 | N3 | 0.0° | 0.0° |
N1 | C6 | C5 | C4 | 0.1° | 0.1° |
N1 | C6 | C5 | O6 | 179.9° | 179.6° |
N1 | C6 | C5 | N7 | 179.9° | 180.0° |
HN1 | N1 | C2 | N2 | 0.1° | 0.3° |
HN1 | N1 | C2 | N3 | 180.0° | 179.7° |
HN1 | N1 | C6 | C5 | 179.9° | 179.7° |
HN1 | N1 | C6 | O6 | 0.0° | 0.1° |
C2 | N2 | HN2 | HN2A | 180.0° | 180.0° |
N2 | C2 | N3 | C4 | 180.0° | 180.0° |
N3 | C2 | N2 | HN2 | 0.0° | 180.0° |
N3 | C2 | N2 | HN2A | 180.0° | 0.0° |
C2 | N3 | C4 | N9 | 179.7° | 180.0° |
C2 | N3 | C4 | C5 | 0.1° | 0.1° |
N3 | C4 | N9 | C5 | 179.8° | 180.0° |
N3 | C4 | C5 | C6 | 0.0° | 0.1° |
N3 | C4 | C5 | N7 | 180.0° | 180.0° |
N3 | C4 | N9 | C8 | 179.8° | 180.0° |
N3 | C4 | N9 | C1' | 0.4° | 0.0° |
N9 | C4 | C5 | C6 | 179.9° | 180.0° |
N9 | C4 | C5 | N7 | 0.1° | 0.0° |
C4 | N9 | C8 | N7 | 0.1° | 0.0° |
C4 | N9 | C8 | C1' | 179.7° | 180.0° |
C4 | N9 | C8 | H8 | 179.9° | 180.0° |
C4 | N9 | C1' | C2' | 44.5° | 88.2° |
C4 | N9 | C1' | O4' | 161.5° | 156.4° |
C4 | N9 | C1' | H1' | 78.6° | 34.2° |
C4 | C5 | C6 | N7 | 180.0° | 179.9° |
C4 | C5 | C6 | O6 | 180.0° | 179.7° |
C4 | C5 | N7 | C8 | 0.2° | 0.0° |
C5 | C4 | N9 | C8 | 0.0° | 0.0° |
C5 | C4 | N9 | C1' | 179.7° | 180.0° |
N4 | C7' | C8' | H7' | 120.0° | 120.1° |
N4 | C7' | C8' | H7'A | 120.0° | 120.0° |
N4 | C7' | H7' | H7'A | 119.7° | 120.0° |
N4 | C7' | C8' | H8' | 88.4° | 60.0° |
N4 | C7' | C8' | H8'A | 151.6° | 59.9° |
HN4 | N4 | C7' | C8' | 45.3° | 11.0° |
HN4 | N4 | C7' | H7' | 74.7° | 131.0° |
HN4 | N4 | C7' | H7'A | 165.3° | 109.0° |
C6 | C5 | N7 | C8 | 179.8° | 179.9° |
N7 | C5 | C6 | O6 | 0.0° | 0.4° |
C5 | N7 | C8 | N9 | 0.2° | 0.0° |
C5 | N7 | C8 | H8 | 179.8° | 180.0° |
N7 | C8 | N9 | H8 | 180.0° | 180.0° |
N7 | C8 | N9 | C1' | 179.6° | 180.0° |
C8 | N9 | C1' | C2' | 135.2° | 91.8° |
C8 | N9 | C1' | O4' | 18.2° | 23.5° |
C8 | N9 | C1' | H1' | 101.7° | 145.8° |
H8 | C8 | N9 | C1' | 0.4° | 0.0° |
N9 | C1' | C2' | O4' | 121.7° | 118.8° |
N9 | C1' | C2' | H1' | 118.6° | 122.3° |
N9 | C1' | O4' | H1' | 118.7° | 122.3° |
N9 | C1' | C2' | C3' | 118.2° | 142.8° |
N9 | C1' | C2' | H2' | 121.8° | 98.6° |
N9 | C1' | C2' | H2'A | 1.8° | 24.1° |
N9 | C1' | O4' | C4' | 89.1° | 159.3° |
C2' | C1' | O4' | H1' | 123.1° | 118.9° |
C1' | C2' | C3' | H2' | 120.0° | 118.6° |
C1' | C2' | C3' | H2'A | 120.0° | 118.7° |
C1' | C2' | H2' | H2'A | 122.1° | 122.7° |
C1' | C2' | C3' | O3' | 94.4° | 118.6° |
C1' | C2' | C3' | C4' | 21.4° | 0.0° |
C1' | C2' | C3' | H3' | 144.7° | 118.6° |
C2' | C1' | O4' | C4' | 29.2° | 40.5° |
O4' | C1' | C2' | C3' | 3.4° | 24.0° |
O4' | C1' | C2' | H2' | 116.6° | 142.6° |
O4' | C1' | C2' | H2'A | 123.4° | 94.7° |
C1' | O4' | C4' | C3' | 43.0° | 40.5° |
C1' | O4' | C4' | C5' | 76.1° | 159.3° |
C1' | O4' | C4' | H4' | 163.8° | 78.4° |
H1' | C1' | C2' | C3' | 123.2° | 94.9° |
H1' | C1' | C2' | H2' | 3.2° | 23.7° |
H1' | C1' | C2' | H2'A | 116.8° | 146.5° |
H1' | C1' | O4' | C4' | 152.2° | 78.4° |
C3' | C2' | H2' | H2'A | 122.1° | 122.6° |
C2' | C3' | O3' | C4' | 111.3° | 114.6° |
C2' | C3' | O3' | H3' | 124.7° | 122.7° |
C2' | C3' | C4' | H3' | 124.2° | 118.6° |
C2' | C3' | O3' | HO3' | 180.0° | 61.5° |
C2' | C3' | C4' | O4' | 39.6° | 23.9° |
C2' | C3' | C4' | C5' | 72.7° | 142.8° |
C2' | C3' | C4' | H4' | 166.1° | 95.0° |
H2' | C2' | C3' | O3' | 25.5° | 0.0° |
H2' | C2' | C3' | C4' | 141.4° | 118.7° |
H2' | C2' | C3' | H3' | 95.3° | 122.8° |
H2'A | C2' | C3' | O3' | 145.6° | 122.7° |
H2'A | C2' | C3' | C4' | 98.6° | 118.7° |
H2'A | C2' | C3' | H3' | 24.7° | 0.1° |
O3' | C3' | C4' | H3' | 121.0° | 122.8° |
O3' | C3' | C4' | O4' | 75.2° | 142.6° |
O3' | C3' | C4' | C5' | 172.5° | 98.6° |
O3' | C3' | C4' | H4' | 51.4° | 23.7° |
C4' | C3' | O3' | HO3' | 68.8° | 176.1° |
C3' | C4' | O4' | C5' | 119.1° | 118.8° |
C3' | C4' | O4' | H4' | 120.8° | 118.9° |
C3' | C4' | C5' | H4' | 121.9° | 122.3° |
C3' | C4' | C5' | O5' | 74.2° | 175.0° |
C3' | C4' | C5' | H5' | 45.8° | 55.0° |
C3' | C4' | C5' | H5'A | 165.8° | 65.0° |
H3' | C3' | O3' | HO3' | 55.3° | 61.2° |
H3' | C3' | C4' | O4' | 163.7° | 94.6° |
H3' | C3' | C4' | C5' | 51.5° | 24.2° |
H3' | C3' | C4' | H4' | 69.7° | 146.4° |
O4' | C4' | C5' | H4' | 126.7° | 122.3° |
O4' | C4' | C5' | O5' | 174.4° | 69.6° |
O4' | C4' | C5' | H5' | 65.6° | 170.4° |
O4' | C4' | C5' | H5'A | 54.4° | 50.4° |
C4' | C5' | O5' | H5' | 120.0° | 120.0° |
C4' | C5' | O5' | H5'A | 120.0° | 120.0° |
C4' | C5' | H5' | H5'A | 118.1° | 120.0° |
H4' | C4' | C5' | O5' | 47.7° | 52.7° |
H4' | C4' | C5' | H5' | 167.7° | 67.3° |
H4' | C4' | C5' | H5'A | 72.3° | 172.7° |
O5' | C5' | H5' | H5'A | 118.1° | 120.0° |
C8' | C7' | H7' | H7'A | 119.7° | 119.9° |
C7' | C8' | H8' | H8'A | 118.4° | 119.9° |
H7' | C7' | C8' | H8' | 151.6° | 60.1° |
H7' | C7' | C8' | H8'A | 31.6° | 180.0° |
H7'A | C7' | C8' | H8' | 31.6° | 180.0° |
H7'A | C7' | C8' | H8'A | 88.4° | 60.1° |