GAE
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C6 | O6A | sing | 1.34Å | 1.25Å | |
O6A | HO6A | sing | 0.97Å | 0.95Å | |
O6B | C6 | doub | 1.21Å | 1.26Å | |
C6 | C5 | sing | 1.51Å | 1.55Å | |
C4 | C5 | sing | 1.53Å | 1.55Å | |
O5 | C5 | sing | 1.43Å | 1.45Å | |
C5 | H5 | sing | 1.09Å | 1.10Å | |
O5 | HO5 | sing | 0.97Å | 0.95Å | |
O4 | C4 | sing | 1.43Å | 1.43Å | |
C4 | C3 | sing | 1.53Å | 1.55Å | |
C4 | H4 | sing | 1.09Å | 1.10Å | |
O4 | HO4 | sing | 0.97Å | 0.95Å | |
O3 | C3 | sing | 1.43Å | 1.43Å | |
C2 | C3 | sing | 1.53Å | 1.55Å | |
C3 | H3 | sing | 1.09Å | 1.10Å | |
O3 | HO3 | sing | 0.97Å | 0.95Å | |
O2 | C2 | sing | 1.43Å | 1.44Å | |
C2 | C1 | sing | 1.51Å | 1.54Å | |
C2 | H2 | sing | 1.09Å | 1.10Å | |
O1A | C1 | doub | 1.21Å | 1.26Å | |
C1 | O1B | sing | 1.34Å | 1.25Å | |
O1B | HO1B | sing | 0.97Å | 0.95Å | |
O2 | HO2 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C6 | O6A | HO6A | 109.5° | 117.0° |
O6A | C6 | O6B | 125.0° | 120.0° |
O6A | C6 | C5 | 116.6° | 120.0° |
O6B | C6 | C5 | 118.5° | 120.0° |
C6 | C5 | C4 | 111.4° | 109.5° |
C6 | C5 | O5 | 110.0° | 109.5° |
C6 | C5 | H5 | 108.2° | 109.5° |
C4 | C5 | O5 | 110.6° | 109.5° |
C4 | C5 | H5 | 107.6° | 109.5° |
C5 | C4 | O4 | 111.0° | 109.5° |
C5 | C4 | C3 | 115.1° | 109.5° |
C5 | C4 | H4 | 103.7° | 109.5° |
O5 | C5 | H5 | 109.0° | 109.4° |
C5 | O5 | HO5 | 109.5° | 114.0° |
O4 | C4 | C3 | 107.4° | 109.5° |
O4 | C4 | H4 | 112.0° | 109.4° |
C4 | O4 | HO4 | 109.5° | 114.0° |
C3 | C4 | H4 | 107.6° | 109.5° |
C4 | C3 | O3 | 108.0° | 109.5° |
C4 | C3 | C2 | 117.6° | 109.5° |
C4 | C3 | H3 | 104.4° | 109.5° |
O3 | C3 | C2 | 107.9° | 109.5° |
O3 | C3 | H3 | 114.8° | 109.4° |
C3 | O3 | HO3 | 109.5° | 114.0° |
C2 | C3 | H3 | 104.5° | 109.5° |
C3 | C2 | O2 | 109.8° | 109.5° |
C3 | C2 | C1 | 113.5° | 109.5° |
C3 | C2 | H2 | 106.4° | 109.5° |
O2 | C2 | C1 | 109.3° | 109.5° |
O2 | C2 | H2 | 110.9° | 109.4° |
C2 | O2 | HO2 | 109.5° | 114.0° |
C1 | C2 | H2 | 107.0° | 109.5° |
C2 | C1 | O1A | 117.1° | 120.0° |
C2 | C1 | O1B | 117.1° | 120.0° |
O1A | C1 | O1B | 125.9° | 120.0° |
C1 | O1B | HO1B | 109.5° | 117.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O6A | C6 | O6B | C5 | 179.3° | 180.0° |
O6A | C6 | C5 | C4 | 154.8° | 65.0° |
O6A | C6 | C5 | O5 | 31.8° | 175.0° |
O6A | C6 | C5 | H5 | 87.2° | 55.0° |
HO6A | O6A | C6 | O6B | 0.0° | 0.0° |
HO6A | O6A | C6 | C5 | 179.4° | 180.0° |
O6B | C6 | C5 | C4 | 25.8° | 115.0° |
O6B | C6 | C5 | O5 | 148.8° | 5.0° |
O6B | C6 | C5 | H5 | 92.2° | 125.0° |
C6 | C5 | C4 | O5 | 122.6° | 120.0° |
C6 | C5 | C4 | H5 | 118.4° | 120.0° |
C6 | C5 | O5 | H5 | 118.5° | 120.0° |
C6 | C5 | O5 | HO5 | 73.3° | 60.1° |
C6 | C5 | C4 | O4 | 74.2° | 55.0° |
C6 | C5 | C4 | C3 | 163.5° | 175.0° |
C6 | C5 | C4 | H4 | 46.3° | 65.0° |
C4 | C5 | O5 | H5 | 118.1° | 120.0° |
C4 | C5 | O5 | HO5 | 50.1° | 60.0° |
C5 | C4 | O4 | C3 | 126.7° | 120.0° |
C5 | C4 | O4 | H4 | 115.4° | 120.0° |
C5 | C4 | C3 | H4 | 115.1° | 120.0° |
C5 | C4 | O4 | HO4 | 150.9° | 60.0° |
C5 | C4 | C3 | O3 | 153.5° | 60.0° |
C5 | C4 | C3 | C2 | 84.2° | NaN° |
C5 | C4 | C3 | H3 | 31.0° | 60.0° |
O5 | C5 | C4 | O4 | 48.5° | 65.0° |
O5 | C5 | C4 | C3 | 73.8° | 55.0° |
O5 | C5 | C4 | H4 | 168.9° | 175.0° |
H5 | C5 | O5 | HO5 | 168.2° | 180.0° |
H5 | C5 | C4 | O4 | 167.4° | 175.0° |
H5 | C5 | C4 | C3 | 45.1° | 65.0° |
H5 | C5 | C4 | H4 | 72.1° | 55.0° |
O4 | C4 | C3 | H4 | 120.7° | 120.0° |
O4 | C4 | C3 | O3 | 82.3° | 180.0° |
O4 | C4 | C3 | C2 | 40.0° | 60.0° |
O4 | C4 | C3 | H3 | 155.2° | 60.0° |
C3 | C4 | O4 | HO4 | 82.4° | 60.0° |
C4 | C3 | O3 | C2 | 128.0° | 120.0° |
C4 | C3 | O3 | H3 | 115.9° | 120.0° |
C4 | C3 | C2 | H3 | 115.1° | 120.0° |
C4 | C3 | O3 | HO3 | 118.5° | 60.0° |
C4 | C3 | C2 | O2 | 64.2° | 55.0° |
C4 | C3 | C2 | C1 | 173.2° | 175.0° |
C4 | C3 | C2 | H2 | 55.8° | 65.0° |
H4 | C4 | O4 | HO4 | 35.5° | 180.0° |
H4 | C4 | C3 | O3 | 38.4° | 60.0° |
H4 | C4 | C3 | C2 | 160.7° | 60.0° |
H4 | C4 | C3 | H3 | 84.1° | 180.0° |
O3 | C3 | C2 | H3 | 122.6° | 120.0° |
O3 | C3 | C2 | O2 | 58.1° | 65.0° |
O3 | C3 | C2 | C1 | 64.5° | 55.0° |
O3 | C3 | C2 | H2 | 178.1° | 175.0° |
C2 | C3 | O3 | HO3 | 113.5° | 60.0° |
C3 | C2 | O2 | C1 | 125.1° | 120.0° |
C3 | C2 | O2 | H2 | 117.3° | 120.0° |
C3 | C2 | C1 | H2 | 117.0° | 120.0° |
C3 | C2 | C1 | O1A | 115.2° | 115.0° |
C3 | C2 | C1 | O1B | 64.3° | 65.0° |
C3 | C2 | O2 | HO2 | 38.3° | 60.0° |
H3 | C3 | O3 | HO3 | 2.5° | 180.0° |
H3 | C3 | C2 | O2 | 179.4° | 175.0° |
H3 | C3 | C2 | C1 | 58.0° | 65.0° |
H3 | C3 | C2 | H2 | 59.3° | 55.0° |
O2 | C2 | C1 | H2 | 120.1° | 120.0° |
O2 | C2 | C1 | O1A | 7.7° | 5.0° |
O2 | C2 | C1 | O1B | 172.8° | 175.0° |
C2 | C1 | O1A | O1B | 179.4° | 180.0° |
C2 | C1 | O1B | HO1B | 179.5° | 180.0° |
C1 | C2 | O2 | HO2 | 163.4° | 60.1° |
H2 | C2 | C1 | O1A | 127.8° | 125.0° |
H2 | C2 | C1 | O1B | 52.7° | 55.0° |
H2 | C2 | O2 | HO2 | 78.9° | 180.0° |
O1A | C1 | O1B | HO1B | 0.0° | 0.0° |