LGP
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
P | OP1 | doub | 1.48Å | 1.48Å | |
P | OP2 | sing | 1.61Å | 1.48Å | |
P | OP3 | sing | 1.61Å | 1.62Å | |
P | O5' | sing | 1.61Å | 1.62Å | |
OP2 | HOP2 | sing | 0.97Å | 0.95Å | |
OP3 | HOP3 | sing | 0.97Å | 0.95Å | |
O5' | C5' | sing | 1.43Å | 1.44Å | |
C5' | C4' | sing | 1.53Å | 1.54Å | |
C5' | H5' | sing | 1.09Å | 1.09Å | |
C5' | H5'' | sing | 1.09Å | 1.09Å | |
C4' | O4' | sing | 1.43Å | 1.43Å | |
C4' | C3' | sing | 1.53Å | 1.54Å | |
C4' | H4' | sing | 1.09Å | 1.09Å | |
O4' | C1' | sing | 1.43Å | 1.43Å | |
C3' | O3' | sing | 1.43Å | 1.43Å | |
C3' | H3'1 | sing | 1.09Å | 1.09Å | |
C3' | H3'2 | sing | 1.09Å | 1.11Å | |
O3' | HO3' | sing | 0.97Å | 0.95Å | |
C1' | N9 | sing | 1.46Å | 1.47Å | |
C1' | H1'1 | sing | 1.09Å | 1.08Å | |
C1' | H1'2 | sing | 1.09Å | 1.09Å | |
N9 | C8 | sing | 1.36Å | 1.35Å | Aromatic |
N9 | C4 | sing | 1.37Å | 1.38Å | Aromatic |
C8 | N7 | doub | 1.30Å | 1.29Å | Aromatic |
C8 | H8 | sing | 1.08Å | 1.08Å | |
N7 | C5 | sing | 1.35Å | 1.40Å | Aromatic |
C5 | C6 | sing | 1.41Å | 1.42Å | |
C5 | C4 | doub | 1.40Å | 1.39Å | Aromatic |
C6 | O6 | doub | 1.22Å | 1.23Å | |
C6 | N1 | sing | 1.35Å | 1.39Å | |
N1 | C2 | sing | 1.36Å | 1.38Å | |
N1 | HN1 | sing | 0.97Å | 1.01Å | |
C2 | N2 | sing | 1.37Å | 1.33Å | |
C2 | N3 | doub | 1.31Å | 1.33Å | |
N2 | HN21 | sing | 0.97Å | 1.01Å | |
N2 | HN22 | sing | 0.97Å | 1.01Å | |
N3 | C4 | sing | 1.34Å | 1.35Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
OP1 | P | OP2 | 119.7° | 109.4° |
OP1 | P | OP3 | 108.0° | 109.5° |
OP1 | P | O5' | 107.9° | 109.5° |
OP2 | P | OP3 | 107.9° | 109.5° |
OP2 | P | O5' | 108.4° | 109.5° |
P | OP2 | HOP2 | 119.6° | 106.8° |
OP3 | P | O5' | 103.8° | 109.5° |
P | OP3 | HOP3 | 108.1° | 106.8° |
P | O5' | C5' | 121.2° | 106.8° |
O5' | C5' | C4' | 112.7° | 109.5° |
O5' | C5' | H5' | 108.6° | 109.4° |
O5' | C5' | H5'' | 109.1° | 109.5° |
C4' | C5' | H5' | 108.7° | 109.5° |
C4' | C5' | H5'' | 109.0° | 109.5° |
C5' | C4' | O4' | 110.5° | 109.5° |
C5' | C4' | C3' | 111.3° | 109.5° |
C5' | C4' | H4' | 108.4° | 109.5° |
H5' | C5' | H5'' | 108.7° | 109.5° |
O4' | C4' | C3' | 111.4° | 109.5° |
O4' | C4' | H4' | 107.4° | 109.4° |
C4' | O4' | C1' | 110.2° | 106.8° |
C3' | C4' | H4' | 107.7° | 109.5° |
C4' | C3' | O3' | 110.6° | 109.5° |
C4' | C3' | H3'1 | 109.4° | 109.5° |
C4' | C3' | H3'2 | 109.2° | 109.5° |
O4' | C1' | N9 | 112.1° | 109.5° |
O4' | C1' | H1'1 | 108.4° | 109.4° |
O4' | C1' | H1'2 | 109.5° | 109.5° |
O3' | C3' | H3'1 | 109.2° | 109.4° |
O3' | C3' | H3'2 | 108.7° | 109.5° |
C3' | O3' | HO3' | 110.6° | 106.8° |
H3'1 | C3' | H3'2 | 109.7° | 109.5° |
N9 | C1' | H1'1 | 109.0° | 109.4° |
N9 | C1' | H1'2 | 108.9° | 109.5° |
C1' | N9 | C8 | 129.4° | 126.3° |
C1' | N9 | C4 | 126.6° | 126.3° |
H1'1 | C1' | H1'2 | 108.9° | 109.5° |
C8 | N9 | C4 | 103.9° | 107.5° |
N9 | C8 | N7 | 117.8° | 109.8° |
N9 | C8 | H8 | 121.0° | 125.1° |
N9 | C4 | C5 | 106.1° | 106.2° |
N9 | C4 | N3 | 126.0° | 134.2° |
N7 | C8 | H8 | 121.3° | 125.1° |
C8 | N7 | C5 | 101.6° | 109.3° |
N7 | C5 | C6 | 130.0° | 134.1° |
N7 | C5 | C4 | 110.6° | 107.3° |
C6 | C5 | C4 | 119.4° | 118.6° |
C5 | C6 | O6 | 128.5° | 120.9° |
C5 | C6 | N1 | 111.6° | 118.4° |
C5 | C4 | N3 | 127.9° | 119.7° |
O6 | C6 | N1 | 119.9° | 120.8° |
C6 | N1 | C2 | 125.2° | 120.3° |
C6 | N1 | HN1 | 115.7° | 119.8° |
C2 | N1 | HN1 | 119.0° | 119.9° |
N1 | C2 | N2 | 116.3° | 119.0° |
N1 | C2 | N3 | 123.7° | 121.9° |
N2 | C2 | N3 | 120.0° | 119.1° |
C2 | N2 | HN21 | 119.7° | 120.0° |
C2 | N2 | HN22 | 120.1° | 120.0° |
C2 | N3 | C4 | 112.2° | 121.1° |
HN21 | N2 | HN22 | 120.2° | 120.1° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
OP1 | P | OP2 | OP3 | 124.0° | 120.0° |
OP1 | P | OP2 | O5' | 124.2° | 120.0° |
OP1 | P | OP3 | O5' | 114.4° | 120.0° |
OP1 | P | OP2 | HOP2 | 180.0° | 60.0° |
OP1 | P | OP3 | HOP3 | 180.0° | 180.0° |
OP1 | P | O5' | C5' | 126.6° | 60.0° |
OP2 | P | OP3 | O5' | 114.8° | 120.0° |
OP2 | P | OP3 | HOP3 | 49.3° | 60.1° |
OP2 | P | O5' | C5' | 4.4° | 180.0° |
OP3 | P | OP2 | HOP2 | 56.0° | 59.9° |
OP3 | P | O5' | C5' | 118.9° | 60.0° |
O5' | P | OP2 | HOP2 | 55.8° | 180.0° |
O5' | P | OP3 | HOP3 | 65.5° | 59.9° |
P | O5' | C5' | C4' | 145.9° | 180.0° |
P | O5' | C5' | H5' | 93.6° | 60.0° |
P | O5' | C5' | H5'' | 24.7° | 60.0° |
O5' | C5' | C4' | H5' | 120.5° | 120.0° |
O5' | C5' | C4' | H5'' | 121.2° | 120.0° |
O5' | C5' | H5' | H5'' | 118.5° | 120.0° |
O5' | C5' | C4' | O4' | 13.4° | 60.0° |
O5' | C5' | C4' | C3' | 110.9° | 180.0° |
O5' | C5' | C4' | H4' | 130.9° | 60.0° |
C4' | C5' | H5' | H5'' | 118.5° | 120.0° |
C5' | C4' | O4' | C3' | 124.2° | 120.0° |
C5' | C4' | O4' | H4' | 118.1° | 120.0° |
C5' | C4' | C3' | H4' | 118.7° | 120.0° |
C5' | C4' | O4' | C1' | 68.8° | 150.0° |
C5' | C4' | C3' | O3' | 22.9° | 60.0° |
C5' | C4' | C3' | H3'1 | 97.4° | 60.0° |
C5' | C4' | C3' | H3'2 | 142.5° | 180.0° |
H5' | C5' | C4' | O4' | 107.1° | 179.9° |
H5' | C5' | C4' | C3' | 128.7° | 60.0° |
H5' | C5' | C4' | H4' | 10.4° | 60.0° |
H5'' | C5' | C4' | O4' | 134.6° | 60.1° |
H5'' | C5' | C4' | C3' | 10.4° | 60.0° |
H5'' | C5' | C4' | H4' | 107.9° | 180.0° |
O4' | C4' | C3' | H4' | 117.6° | 120.0° |
O4' | C4' | C3' | O3' | 146.7° | 60.0° |
O4' | C4' | C3' | H3'1 | 26.4° | 180.0° |
O4' | C4' | C3' | H3'2 | 93.8° | 60.0° |
C4' | O4' | C1' | N9 | 171.4° | 180.0° |
C4' | O4' | C1' | H1'1 | 68.3° | 60.1° |
C4' | O4' | C1' | H1'2 | 50.4° | 59.9° |
C3' | C4' | O4' | C1' | 167.0° | 89.9° |
C4' | C3' | O3' | H3'1 | 120.5° | 120.0° |
C4' | C3' | O3' | H3'2 | 119.9° | 120.0° |
C4' | C3' | H3'1 | H3'2 | 119.8° | 120.0° |
C4' | C3' | O3' | HO3' | 180.0° | 180.0° |
H4' | C4' | O4' | C1' | 49.3° | 30.1° |
H4' | C4' | C3' | O3' | 95.7° | 180.0° |
H4' | C4' | C3' | H3'1 | 143.9° | 60.0° |
H4' | C4' | C3' | H3'2 | 23.8° | 60.0° |
O4' | C1' | N9 | H1'1 | 120.0° | 119.9° |
O4' | C1' | N9 | H1'2 | 121.3° | 120.1° |
O4' | C1' | H1'1 | H1'2 | 119.0° | 120.0° |
O4' | C1' | N9 | C8 | 63.2° | 0.1° |
O4' | C1' | N9 | C4 | 118.3° | 180.0° |
O3' | C3' | H3'1 | H3'2 | 119.0° | 120.0° |
H3'1 | C3' | O3' | HO3' | 59.5° | 60.0° |
H3'2 | C3' | O3' | HO3' | 60.2° | 60.0° |
N9 | C1' | H1'1 | H1'2 | 118.7° | 120.0° |
C1' | N9 | C8 | C4 | 178.8° | 179.9° |
C1' | N9 | C8 | N7 | 178.6° | 179.9° |
C1' | N9 | C8 | H8 | 2.6° | 0.1° |
C1' | N9 | C4 | C5 | 178.8° | 179.9° |
C1' | N9 | C4 | N3 | 1.4° | 0.1° |
H1'1 | C1' | N9 | C8 | 56.9° | 120.1° |
H1'1 | C1' | N9 | C4 | 121.7° | 60.1° |
H1'2 | C1' | N9 | C8 | 175.5° | 119.9° |
H1'2 | C1' | N9 | C4 | 3.0° | 59.9° |
N9 | C8 | N7 | H8 | 178.8° | 180.0° |
N9 | C8 | N7 | C5 | 0.2° | 0.0° |
C8 | N9 | C4 | C5 | 0.1° | 0.0° |
C8 | N9 | C4 | N3 | 179.8° | 180.0° |
C4 | N9 | C8 | N7 | 0.2° | 0.0° |
C4 | N9 | C8 | H8 | 178.6° | 180.0° |
N9 | C4 | C5 | N7 | 0.0° | 0.0° |
N9 | C4 | C5 | C6 | 179.8° | 180.0° |
N9 | C4 | C5 | N3 | 179.8° | 180.0° |
N9 | C4 | N3 | C2 | 179.6° | 179.9° |
C8 | N7 | C5 | C6 | 179.7° | 180.0° |
C8 | N7 | C5 | C4 | 0.1° | 0.0° |
H8 | C8 | N7 | C5 | 178.6° | 180.0° |
N7 | C5 | C6 | C4 | 179.8° | 180.0° |
N7 | C5 | C6 | O6 | 0.3° | 0.0° |
N7 | C5 | C6 | N1 | 179.6° | 179.7° |
N7 | C5 | C4 | N3 | 179.9° | 179.9° |
C5 | C6 | O6 | N1 | 179.9° | 179.7° |
C5 | C6 | N1 | C2 | 0.1° | 0.5° |
C5 | C6 | N1 | HN1 | 179.4° | 180.0° |
C6 | C5 | C4 | N3 | 0.0° | 0.0° |
C4 | C5 | C6 | O6 | 179.9° | 180.0° |
C4 | C5 | C6 | N1 | 0.2° | 0.2° |
C5 | C4 | N3 | C2 | 0.3° | 0.1° |
O6 | C6 | N1 | C2 | 179.9° | 179.7° |
O6 | C6 | N1 | HN1 | 0.5° | 0.2° |
C6 | N1 | C2 | HN1 | 179.6° | 179.5° |
C6 | N1 | C2 | N2 | 179.6° | 179.8° |
C6 | N1 | C2 | N3 | 0.1° | 0.6° |
N1 | C2 | N2 | N3 | 179.7° | 179.6° |
N1 | C2 | N2 | HN21 | 179.9° | 179.7° |
N1 | C2 | N2 | HN22 | 1.1° | 0.6° |
N1 | C2 | N3 | C4 | 0.3° | 0.4° |
HN1 | N1 | C2 | N2 | 0.1° | 0.3° |
HN1 | N1 | C2 | N3 | 179.6° | 179.9° |
C2 | N2 | HN21 | HN22 | 178.8° | 179.6° |
N2 | C2 | N3 | C4 | 179.4° | 180.0° |
N3 | C2 | N2 | HN21 | 0.2° | 0.1° |
N3 | C2 | N2 | HN22 | 178.6° | 179.7° |