M33
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N6 | C6 | sing | 1.38Å | 1.33Å | |
O2A | PA | doub | 1.48Å | 1.48Å | |
C6 | C5 | doub | 1.41Å | 1.39Å | Aromatic |
C6 | N1 | sing | 1.33Å | 1.34Å | Aromatic |
N7 | C5 | sing | 1.35Å | 1.33Å | Aromatic |
N7 | C8 | doub | 1.30Å | 1.33Å | Aromatic |
O1A | PA | sing | 1.61Å | 1.48Å | |
C5' | O5' | sing | 1.43Å | 1.43Å | |
C5' | C4' | sing | 1.53Å | 1.53Å | |
C5 | C4 | sing | 1.41Å | 1.39Å | Aromatic |
N1 | C2 | doub | 1.32Å | 1.32Å | Aromatic |
O4' | C4' | sing | 1.44Å | 1.44Å | |
O4' | C1' | sing | 1.44Å | 1.44Å | |
C8 | N9 | sing | 1.36Å | 1.33Å | Aromatic |
PA | O5' | sing | 1.61Å | 1.61Å | |
PA | O3A | sing | 1.61Å | 1.61Å | |
C2 | N3 | sing | 1.32Å | 1.32Å | Aromatic |
C4 | N9 | sing | 1.37Å | 1.33Å | Aromatic |
C4 | N3 | doub | 1.33Å | 1.34Å | Aromatic |
C4' | C3' | sing | 1.54Å | 1.53Å | |
N9 | C1' | sing | 1.47Å | 1.48Å | |
C1' | C2' | sing | 1.55Å | 1.53Å | |
O1B | PB | doub | 1.48Å | 1.48Å | |
O3A | PB | sing | 1.61Å | 1.61Å | |
C3' | C2' | sing | 1.54Å | 1.53Å | |
C3' | O3' | sing | 1.43Å | 1.43Å | |
C2' | O2' | sing | 1.43Å | 1.43Å | |
O2B | PB | sing | 1.61Å | 1.48Å | |
PB | C3B | sing | 1.82Å | 1.81Å | |
O2B | HO2B | sing | 0.97Å | 0.95Å | |
C3B | H3B1 | sing | 1.09Å | 1.10Å | |
C3B | H3B2 | sing | 1.09Å | 1.10Å | |
C3B | H3B3 | sing | 1.09Å | 1.10Å | |
O1A | HO1A | sing | 0.97Å | 0.95Å | |
C5' | H5'1 | sing | 1.09Å | 1.10Å | |
C5' | H5'2 | sing | 1.09Å | 1.10Å | |
C4' | H4' | sing | 1.09Å | 1.10Å | |
C3' | H3' | sing | 1.09Å | 1.10Å | |
O3' | HO3' | sing | 0.97Å | 0.95Å | |
C2' | H2' | sing | 1.09Å | 1.10Å | |
O2' | HO2' | sing | 0.97Å | 0.95Å | |
C1' | H1' | sing | 1.09Å | 1.10Å | |
C8 | H8 | sing | 1.08Å | 1.08Å | |
N6 | HN61 | sing | 0.97Å | 1.00Å | |
N6 | HN62 | sing | 0.97Å | 1.00Å | |
C2 | H2 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N6 | C6 | C5 | 120.2° | 120.8° |
N6 | C6 | N1 | 121.1° | 120.8° |
C6 | N6 | HN61 | 109.5° | 120.0° |
C6 | N6 | HN62 | 109.5° | 120.0° |
O2A | PA | O1A | 118.5° | 109.5° |
O2A | PA | O5' | 109.2° | 109.5° |
O2A | PA | O3A | 107.9° | 109.5° |
C5 | C6 | N1 | 118.7° | 118.4° |
C6 | C5 | N7 | 133.7° | 134.7° |
C6 | C5 | C4 | 118.6° | 118.2° |
C6 | N1 | C2 | 121.0° | 121.2° |
C5 | N7 | C8 | 107.7° | 109.5° |
N7 | C5 | C4 | 107.6° | 107.1° |
N7 | C8 | N9 | 109.8° | 110.0° |
N7 | C8 | H8 | 125.1° | 125.1° |
O1A | PA | O5' | 109.7° | 109.5° |
O1A | PA | O3A | 107.9° | 109.5° |
PA | O1A | HO1A | 109.5° | 114.0° |
O5' | C5' | C4' | 111.9° | 109.5° |
C5' | O5' | PA | 119.9° | 123.0° |
O5' | C5' | H5'1 | 108.7° | 109.4° |
O5' | C5' | H5'2 | 108.2° | 109.5° |
C5' | C4' | O4' | 109.0° | 110.4° |
C5' | C4' | C3' | 108.7° | 110.4° |
C4' | C5' | H5'1 | 108.7° | 109.5° |
C4' | C5' | H5'2 | 108.1° | 109.5° |
C5' | C4' | H4' | 108.3° | 110.3° |
C5 | C4 | N9 | 107.0° | 106.0° |
C5 | C4 | N3 | 119.5° | 119.1° |
N1 | C2 | N3 | 122.0° | 122.5° |
N1 | C2 | H2 | 119.0° | 118.8° |
C4' | O4' | C1' | 107.1° | 105.3° |
O4' | C4' | C3' | 102.6° | 104.8° |
O4' | C4' | H4' | 113.9° | 110.5° |
O4' | C1' | N9 | 112.0° | 110.3° |
O4' | C1' | C2' | 106.3° | 104.8° |
O4' | C1' | H1' | 109.7° | 110.4° |
C8 | N9 | C4 | 108.0° | 107.5° |
C8 | N9 | C1' | 125.4° | 126.3° |
N9 | C8 | H8 | 125.1° | 125.0° |
O5' | PA | O3A | 102.5° | 109.5° |
PA | O3A | PB | 120.6° | 134.0° |
C2 | N3 | C4 | 120.3° | 120.7° |
N3 | C2 | H2 | 119.0° | 118.8° |
N9 | C4 | N3 | 133.6° | 134.9° |
C4 | N9 | C1' | 126.6° | 126.3° |
C4' | C3' | C2' | 97.5° | 104.1° |
C4' | C3' | O3' | 109.7° | 110.5° |
C3' | C4' | H4' | 114.1° | 110.3° |
C4' | C3' | H3' | 116.7° | 110.5° |
N9 | C1' | C2' | 108.7° | 110.4° |
N9 | C1' | H1' | 107.3° | 110.4° |
C1' | C2' | C3' | 100.1° | 104.0° |
C1' | C2' | O2' | 109.9° | 110.5° |
C1' | C2' | H2' | 115.3° | 110.6° |
C2' | C1' | H1' | 112.9° | 110.4° |
O1B | PB | O3A | 97.5° | 109.4° |
O1B | PB | O2B | 125.1° | 109.5° |
O1B | PB | C3B | 117.6° | 109.5° |
O3A | PB | O2B | 98.0° | 109.5° |
O3A | PB | C3B | 92.1° | 109.5° |
C2' | C3' | O3' | 109.2° | 110.5° |
C3' | C2' | O2' | 109.9° | 110.5° |
C2' | C3' | H3' | 117.1° | 110.5° |
C3' | C2' | H2' | 115.2° | 110.5° |
O3' | C3' | H3' | 106.4° | 110.5° |
C3' | O3' | HO3' | 109.5° | 114.0° |
O2' | C2' | H2' | 106.4° | 110.5° |
C2' | O2' | HO2' | 109.5° | 114.0° |
O2B | PB | C3B | 114.0° | 109.5° |
PB | O2B | HO2B | 109.5° | 114.0° |
PB | C3B | H3B1 | 109.5° | 109.5° |
PB | C3B | H3B2 | 109.4° | 109.5° |
PB | C3B | H3B3 | 109.4° | 109.5° |
H3B1 | C3B | H3B2 | 109.5° | 109.5° |
H3B1 | C3B | H3B3 | 109.5° | 109.5° |
H3B2 | C3B | H3B3 | 109.5° | 109.5° |
H5'1 | C5' | H5'2 | 111.3° | 109.5° |
HN61 | N6 | HN62 | 109.4° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N6 | C6 | C5 | N1 | 177.2° | 180.0° |
N6 | C6 | C5 | N7 | 2.4° | 0.0° |
N6 | C6 | C5 | C4 | 176.8° | 179.8° |
N6 | C6 | N1 | C2 | 177.0° | 180.0° |
C6 | N6 | HN61 | HN62 | 120.0° | 180.0° |
O2A | PA | O1A | O5' | 126.3° | 120.0° |
O2A | PA | O1A | O3A | 122.8° | 120.0° |
O2A | PA | O5' | C5' | 123.3° | 55.0° |
O2A | PA | O5' | O3A | 114.2° | 120.0° |
O2A | PA | O3A | PB | 37.0° | 39.9° |
O2A | PA | O1A | HO1A | 35.0° | 180.0° |
C6 | C5 | N7 | C4 | 179.2° | 179.8° |
C6 | C5 | N7 | C8 | 179.0° | 180.0° |
C5 | C6 | N1 | C2 | 0.2° | 0.0° |
C6 | C5 | C4 | N9 | 178.9° | 179.8° |
C6 | C5 | C4 | N3 | 0.3° | 0.5° |
C5 | C6 | N6 | HN61 | 73.1° | 0.0° |
C5 | C6 | N6 | HN62 | 166.9° | 180.0° |
N1 | C6 | C5 | N7 | 179.6° | 179.9° |
N1 | C6 | C5 | C4 | 0.5° | 0.3° |
C6 | N1 | C2 | N3 | 0.1° | 0.1° |
N1 | C6 | N6 | HN61 | 104.0° | 180.0° |
N1 | C6 | N6 | HN62 | 16.0° | 0.1° |
C6 | N1 | C2 | H2 | 179.9° | 179.9° |
C5 | N7 | C8 | N9 | 0.1° | 0.0° |
N7 | C5 | C4 | N9 | 0.5° | 0.4° |
N7 | C5 | C4 | N3 | 179.7° | 179.6° |
C5 | N7 | C8 | H8 | 179.9° | 180.0° |
C8 | N7 | C5 | C4 | 0.3° | 0.2° |
N7 | C8 | N9 | H8 | 180.0° | 180.0° |
N7 | C8 | N9 | C4 | 0.4° | 0.3° |
N7 | C8 | N9 | C1' | 177.4° | 180.0° |
O1A | PA | O5' | C5' | 8.1° | 64.9° |
O1A | PA | O5' | O3A | 114.4° | 120.0° |
O1A | PA | O3A | PB | 166.1° | 80.0° |
O5' | C5' | C4' | H5'1 | 120.0° | 120.0° |
O5' | C5' | C4' | H5'2 | 119.0° | 120.0° |
O5' | C5' | C4' | O4' | 172.3° | 69.6° |
C5' | O5' | PA | O3A | 122.5° | 175.0° |
O5' | C5' | C4' | C3' | 61.2° | 175.0° |
O5' | C5' | H5'1 | H5'2 | 119.1° | 120.0° |
O5' | C5' | C4' | H4' | 63.2° | 52.8° |
C5' | C4' | O4' | C3' | 115.1° | 118.8° |
C5' | C4' | O4' | H4' | 121.1° | 122.3° |
C5' | C4' | O4' | C1' | 82.1° | 159.4° |
C4' | C5' | O5' | PA | 165.5° | 180.0° |
C5' | C4' | C3' | H4' | 121.0° | 122.2° |
C5' | C4' | C3' | C2' | 66.0° | 142.8° |
C5' | C4' | C3' | O3' | 179.5° | 98.5° |
C4' | C5' | H5'1 | H5'2 | 119.0° | 120.0° |
C5' | C4' | C3' | H3' | 59.5° | 24.1° |
C5 | C4 | N9 | C8 | 0.5° | 0.4° |
C5 | C4 | N3 | C2 | 0.0° | 0.6° |
C5 | C4 | N9 | N3 | 179.0° | 179.1° |
C5 | C4 | N9 | C1' | 177.2° | 179.9° |
N1 | C2 | N3 | H2 | 180.0° | 180.0° |
N1 | C2 | N3 | C4 | 0.3° | 0.4° |
O4' | C4' | C3' | H4' | 123.7° | 118.9° |
C4' | O4' | C1' | N9 | 115.7° | 159.3° |
C4' | O4' | C1' | C2' | 2.8° | 40.5° |
O4' | C4' | C3' | C2' | 49.3° | 24.0° |
O4' | C4' | C3' | O3' | 64.2° | 142.6° |
O4' | C4' | C5' | H5'1 | 67.6° | 50.4° |
O4' | C4' | C5' | H5'2 | 53.3° | 170.4° |
O4' | C4' | C3' | H3' | 174.8° | 94.7° |
C4' | O4' | C1' | H1' | 125.2° | 78.3° |
O4' | C1' | N9 | C8 | 73.6° | 23.6° |
O4' | C1' | N9 | C4 | 109.1° | 156.8° |
C1' | O4' | C4' | C3' | 33.0° | 40.5° |
O4' | C1' | N9 | C2' | 117.1° | 115.4° |
O4' | C1' | N9 | H1' | 120.4° | 122.3° |
O4' | C1' | C2' | H1' | 120.3° | 118.9° |
O4' | C1' | C2' | C3' | 28.2° | 24.0° |
O4' | C1' | C2' | O2' | 143.8° | 142.6° |
C1' | O4' | C4' | H4' | 156.8° | 78.3° |
O4' | C1' | C2' | H2' | 96.1° | 94.7° |
C8 | N9 | C4 | C1' | 177.8° | 179.7° |
C8 | N9 | C4 | N3 | 179.6° | 179.4° |
C8 | N9 | C1' | C2' | 43.6° | 91.8° |
C8 | N9 | C1' | H1' | 166.0° | 145.9° |
O5' | PA | O3A | PB | 78.2° | 159.9° |
O5' | PA | O1A | HO1A | 91.3° | 60.0° |
PA | O5' | C5' | H5'1 | 74.5° | 60.0° |
PA | O5' | C5' | H5'2 | 46.5° | 59.9° |
PA | O3A | PB | O1B | 70.6° | 60.1° |
PA | O3A | PB | O2B | 56.6° | 59.9° |
PA | O3A | PB | C3B | 171.2° | 180.0° |
O3A | PA | O1A | HO1A | 157.8° | 60.0° |
C2 | N3 | C4 | N9 | 179.0° | 179.6° |
C4 | N9 | C1' | C2' | 133.8° | 87.9° |
C4 | N9 | C1' | H1' | 11.4° | 34.4° |
C4 | N9 | C8 | H8 | 179.6° | 179.8° |
N3 | C4 | N9 | C1' | 1.8° | 0.8° |
C4 | N3 | C2 | H2 | 179.8° | 179.7° |
C4' | C3' | C2' | C1' | 45.8° | 0.0° |
C4' | C3' | C2' | O3' | 113.9° | 118.7° |
C4' | C3' | C2' | H3' | 125.2° | 118.7° |
C4' | C3' | O3' | H3' | 127.1° | 122.6° |
C4' | C3' | C2' | O2' | 161.3° | 118.6° |
C3' | C4' | C5' | H5'1 | 178.7° | 65.0° |
C3' | C4' | C5' | H5'2 | 57.8° | 55.0° |
C4' | C3' | O3' | HO3' | 4.2° | 180.0° |
C4' | C3' | C2' | H2' | 78.5° | 118.8° |
N9 | C1' | C2' | H1' | 119.0° | 122.3° |
N9 | C1' | C2' | C3' | 148.9° | 142.8° |
N9 | C1' | C2' | O2' | 95.5° | 98.6° |
N9 | C1' | C2' | H2' | 24.6° | 24.1° |
C1' | N9 | C8 | H8 | 2.6° | 0.1° |
C1' | C2' | C3' | O2' | 115.6° | 118.6° |
C1' | C2' | C3' | H2' | 124.3° | 118.8° |
C1' | C2' | C3' | O3' | 68.1° | 118.6° |
C1' | C2' | O2' | H2' | 125.4° | 122.8° |
C1' | C2' | C3' | H3' | 171.0° | 118.7° |
C1' | C2' | O2' | HO2' | 51.0° | 176.1° |
O1B | PB | O3A | O2B | 127.2° | 120.0° |
O1B | PB | O3A | C3B | 118.2° | 120.0° |
O1B | PB | O2B | C3B | 159.0° | 120.0° |
O1B | PB | O2B | HO2B | 37.3° | 180.0° |
O1B | PB | C3B | H3B1 | 93.5° | 60.0° |
O1B | PB | C3B | H3B2 | 26.6° | 180.0° |
O1B | PB | C3B | H3B3 | 146.6° | 60.0° |
O3A | PB | O2B | C3B | 95.9° | 120.0° |
O3A | PB | O2B | HO2B | 67.8° | 60.1° |
O3A | PB | C3B | H3B1 | 6.1° | 180.0° |
O3A | PB | C3B | H3B2 | 126.1° | 60.0° |
O3A | PB | C3B | H3B3 | 113.9° | 60.0° |
C2' | C3' | O3' | H3' | 127.3° | 122.7° |
C3' | C2' | O2' | H2' | 125.4° | 122.6° |
C2' | C3' | C4' | H4' | 173.0° | 95.0° |
C2' | C3' | O3' | HO3' | 101.5° | 65.4° |
C3' | C2' | O2' | HO2' | 160.3° | 61.5° |
C3' | C2' | C1' | H1' | 92.2° | 94.9° |
O3' | C3' | C2' | O2' | 47.5° | 0.0° |
O3' | C3' | C4' | H4' | 59.5° | 23.7° |
O3' | C3' | C2' | H2' | 167.6° | 122.6° |
O2' | C2' | C3' | H3' | 73.4° | 122.7° |
O2' | C2' | C1' | H1' | 23.5° | 23.8° |
O2B | PB | C3B | H3B1 | 105.8° | 60.0° |
O2B | PB | C3B | H3B2 | 134.1° | 60.0° |
O2B | PB | C3B | H3B3 | 14.1° | 180.0° |
C3B | PB | O2B | HO2B | 163.7° | 60.0° |
PB | C3B | H3B1 | H3B2 | 120.0° | 120.0° |
PB | C3B | H3B1 | H3B3 | 120.0° | 120.0° |
PB | C3B | H3B2 | H3B3 | 120.0° | 120.0° |
H3B1 | C3B | H3B2 | H3B3 | 120.0° | 120.0° |
H5'1 | C5' | C4' | H4' | 56.8° | 172.8° |
H5'2 | C5' | C4' | H4' | 177.7° | 67.2° |
H4' | C4' | C3' | H3' | 61.5° | 146.4° |
H3' | C3' | O3' | HO3' | 131.2° | 57.3° |
H3' | C3' | C2' | H2' | 46.7° | 0.1° |
H2' | C2' | O2' | HO2' | 74.4° | 61.1° |
H2' | C2' | C1' | H1' | 143.6° | 146.4° |