2GS
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O5 | sing | 1.43Å | 1.50Å | |
| C1 | C2 | sing | 1.53Å | 1.59Å | |
| C1 | O1 | sing | 1.43Å | 1.44Å | |
| C1 | H1 | sing | 1.10Å | 1.10Å | |
| C2 | O2 | sing | 1.43Å | 1.44Å | |
| C2 | C3 | sing | 1.53Å | 1.58Å | |
| C2 | H2 | sing | 1.10Å | 1.10Å | |
| C3 | C4 | sing | 1.53Å | 1.57Å | |
| C3 | O3 | sing | 1.42Å | 1.39Å | |
| C3 | H3 | sing | 1.10Å | 1.10Å | |
| C4 | O4 | sing | 1.42Å | 1.44Å | |
| C4 | C5 | sing | 1.54Å | 1.57Å | |
| C4 | H4 | sing | 1.10Å | 1.10Å | |
| C5 | O5 | sing | 1.43Å | 1.48Å | |
| C5 | C6 | sing | 1.53Å | 1.51Å | |
| C5 | H5 | sing | 1.10Å | 1.10Å | |
| C6 | O6 | sing | 1.42Å | 1.43Å | |
| C6 | H61 | sing | 1.09Å | 1.10Å | |
| C6 | H62 | sing | 1.09Å | 1.10Å | |
| C7 | O2 | sing | 1.42Å | 1.45Å | |
| C7 | H71 | sing | 1.09Å | 1.10Å | |
| C7 | H72 | sing | 1.09Å | 1.10Å | |
| C7 | H73 | sing | 1.09Å | 1.10Å | |
| O1 | HO1 | sing | 0.97Å | 0.95Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| O6 | HO6 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O5 | C1 | C2 | 109.7° | 110.9° |
| O5 | C1 | O1 | 110.1° | 110.4° |
| O5 | C1 | H1 | 109.6° | 109.2° |
| C1 | O5 | C5 | 114.6° | 114.7° |
| C2 | C1 | O1 | 111.5° | 108.3° |
| C2 | C1 | H1 | 108.1° | 111.0° |
| C1 | C2 | O2 | 110.5° | 109.8° |
| C1 | C2 | C3 | 109.4° | 111.1° |
| C1 | C2 | H2 | 109.7° | 109.1° |
| O1 | C1 | H1 | 107.8° | 107.0° |
| C1 | O1 | HO1 | 109.5° | 106.4° |
| O2 | C2 | C3 | 111.9° | 109.3° |
| O2 | C2 | H2 | 107.0° | 106.8° |
| C2 | O2 | C7 | 122.6° | 111.4° |
| C3 | C2 | H2 | 108.2° | 110.7° |
| C2 | C3 | C4 | 109.1° | 110.6° |
| C2 | C3 | O3 | 110.0° | 108.4° |
| C2 | C3 | H3 | 109.9° | 110.9° |
| C4 | C3 | O3 | 111.2° | 110.7° |
| C4 | C3 | H3 | 108.7° | 109.2° |
| C3 | C4 | O4 | 109.7° | 109.9° |
| C3 | C4 | C5 | 109.0° | 113.2° |
| C3 | C4 | H4 | 110.1° | 107.3° |
| O3 | C3 | H3 | 107.9° | 106.9° |
| C3 | O3 | HO3 | 109.5° | 106.6° |
| O4 | C4 | C5 | 110.8° | 111.6° |
| O4 | C4 | H4 | 108.3° | 107.0° |
| C4 | O4 | HO4 | 109.5° | 106.3° |
| C5 | C4 | H4 | 108.9° | 107.5° |
| C4 | C5 | O5 | 110.0° | 110.7° |
| C4 | C5 | C6 | 111.5° | 115.6° |
| C4 | C5 | H5 | 107.6° | 107.2° |
| O5 | C5 | C6 | 108.9° | 111.4° |
| O5 | C5 | H5 | 110.2° | 106.0° |
| C6 | C5 | H5 | 108.7° | 105.1° |
| C5 | C6 | O6 | 111.2° | 108.7° |
| C5 | C6 | H61 | 108.9° | 110.0° |
| C5 | C6 | H62 | 108.5° | 110.0° |
| O6 | C6 | H61 | 108.9° | 109.3° |
| O6 | C6 | H62 | 108.5° | 109.2° |
| C6 | O6 | HO6 | 109.5° | 107.0° |
| H61 | C6 | H62 | 110.8° | 109.6° |
| O2 | C7 | H71 | 109.5° | 109.5° |
| O2 | C7 | H72 | 109.5° | 109.5° |
| O2 | C7 | H73 | 109.4° | 109.0° |
| H71 | C7 | H72 | 109.5° | 110.1° |
| H71 | C7 | H73 | 109.5° | 109.4° |
| H72 | C7 | H73 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O5 | C1 | C2 | O1 | 122.2° | 121.3° |
| O5 | C1 | C2 | H1 | 119.5° | 121.5° |
| O5 | C1 | O1 | H1 | 119.5° | 118.7° |
| O5 | C1 | C2 | O2 | 179.3° | 65.6° |
| O5 | C1 | C2 | C3 | 55.7° | 55.4° |
| O5 | C1 | C2 | H2 | 62.9° | 177.7° |
| C1 | O5 | C5 | C4 | 59.1° | 56.8° |
| C1 | O5 | C5 | C6 | 178.5° | 73.4° |
| C1 | O5 | C5 | H5 | 59.3° | 172.7° |
| O5 | C1 | O1 | HO1 | 73.2° | 12.2° |
| C2 | C1 | O1 | H1 | 118.5° | 119.7° |
| C1 | C2 | O2 | C3 | 122.1° | 122.1° |
| C1 | C2 | O2 | H2 | 119.4° | 118.1° |
| C1 | C2 | C3 | H2 | 119.5° | 121.4° |
| C1 | C2 | C3 | C4 | 57.8° | 49.9° |
| C1 | C2 | C3 | O3 | 180.0° | 71.7° |
| C1 | C2 | C3 | H3 | 61.4° | 171.2° |
| C2 | C1 | O5 | C5 | 57.6° | 60.0° |
| C1 | C2 | O2 | C7 | 144.9° | 177.9° |
| C2 | C1 | O1 | HO1 | 164.7° | 109.4° |
| O1 | C1 | C2 | O2 | 57.1° | 55.7° |
| O1 | C1 | C2 | C3 | 66.6° | 176.7° |
| O1 | C1 | C2 | H2 | 174.9° | 61.0° |
| O1 | C1 | O5 | C5 | 65.4° | 179.9° |
| H1 | C1 | C2 | O2 | 61.2° | 172.9° |
| H1 | C1 | C2 | C3 | 175.1° | 66.1° |
| H1 | C1 | C2 | H2 | 56.6° | 56.2° |
| H1 | C1 | O5 | C5 | 176.2° | 62.6° |
| H1 | C1 | O1 | HO1 | 46.2° | 130.9° |
| O2 | C2 | C3 | H2 | 117.7° | 117.3° |
| O2 | C2 | C3 | C4 | 179.4° | 71.4° |
| O2 | C2 | C3 | O3 | 57.2° | 167.0° |
| O2 | C2 | C3 | H3 | 61.5° | 49.9° |
| C2 | O2 | C7 | H71 | 119.6° | 146.5° |
| C2 | O2 | C7 | H72 | 120.4° | 92.7° |
| C2 | O2 | C7 | H73 | 0.4° | 26.9° |
| C2 | C3 | C4 | O3 | 121.5° | 120.2° |
| C2 | C3 | C4 | H3 | 119.9° | 122.3° |
| C2 | C3 | O3 | H3 | 119.9° | 119.6° |
| C2 | C3 | C4 | O4 | 62.5° | 173.6° |
| C2 | C3 | C4 | C5 | 58.9° | 48.1° |
| C2 | C3 | C4 | H4 | 178.4° | 70.4° |
| C3 | C2 | O2 | C7 | 92.9° | 60.0° |
| C2 | C3 | O3 | HO3 | 121.6° | 81.1° |
| H2 | C2 | C3 | C4 | 61.7° | 171.3° |
| H2 | C2 | C3 | O3 | 60.6° | 49.7° |
| H2 | C2 | C3 | H3 | 179.2° | 67.4° |
| H2 | C2 | O2 | C7 | 25.5° | 59.7° |
| C4 | C3 | O3 | H3 | 119.1° | 118.9° |
| C3 | C4 | O4 | C5 | 120.4° | 126.5° |
| C3 | C4 | O4 | H4 | 120.2° | 116.2° |
| C3 | C4 | C5 | H4 | 120.2° | 118.3° |
| C3 | C4 | C5 | O5 | 58.3° | 50.3° |
| C3 | C4 | C5 | C6 | 179.2° | 77.7° |
| C3 | C4 | C5 | H5 | 61.8° | 165.5° |
| C4 | C3 | O3 | HO3 | 117.4° | 157.4° |
| C3 | C4 | O4 | HO4 | 71.0° | 178.4° |
| O3 | C3 | C4 | O4 | 59.0° | 53.4° |
| O3 | C3 | C4 | C5 | 179.6° | 72.2° |
| O3 | C3 | C4 | H4 | 60.1° | 169.4° |
| H3 | C3 | C4 | O4 | 177.5° | 64.1° |
| H3 | C3 | C4 | C5 | 61.0° | 170.4° |
| H3 | C3 | C4 | H4 | 58.5° | 52.0° |
| H3 | C3 | O3 | HO3 | 1.7° | 38.5° |
| O4 | C4 | C5 | H4 | 119.0° | 117.1° |
| O4 | C4 | C5 | O5 | 62.5° | 174.9° |
| O4 | C4 | C5 | C6 | 58.4° | 46.9° |
| O4 | C4 | C5 | H5 | 177.5° | 69.9° |
| C4 | C5 | O5 | C6 | 122.4° | 130.2° |
| C4 | C5 | O5 | H5 | 118.5° | 115.9° |
| C4 | C5 | C6 | H5 | 118.4° | 118.0° |
| C4 | C5 | C6 | O6 | 179.8° | 179.6° |
| C4 | C5 | C6 | H61 | 60.1° | 60.0° |
| C4 | C5 | C6 | H62 | 60.6° | 60.9° |
| C5 | C4 | O4 | HO4 | 168.6° | 55.1° |
| H4 | C4 | C5 | O5 | 178.5° | 68.1° |
| H4 | C4 | C5 | C6 | 60.6° | 164.0° |
| H4 | C4 | C5 | H5 | 58.4° | 47.2° |
| H4 | C4 | O4 | HO4 | 49.1° | 62.2° |
| O5 | C5 | C6 | H5 | 120.1° | 114.4° |
| O5 | C5 | C6 | O6 | 58.7° | 51.9° |
| O5 | C5 | C6 | H61 | 61.4° | 67.7° |
| O5 | C5 | C6 | H62 | 177.9° | 171.4° |
| C5 | C6 | O6 | H61 | 120.0° | 120.0° |
| C5 | C6 | O6 | H62 | 119.2° | 120.0° |
| C5 | C6 | H61 | H62 | 119.2° | 121.1° |
| C5 | C6 | O6 | HO6 | 118.1° | 13.5° |
| H5 | C5 | C6 | O6 | 61.4° | 62.5° |
| H5 | C5 | C6 | H61 | 178.5° | 177.9° |
| H5 | C5 | C6 | H62 | 57.8° | 57.0° |
| O6 | C6 | H61 | H62 | 119.3° | 119.7° |
| H61 | C6 | O6 | HO6 | 1.9° | 106.6° |
| H62 | C6 | O6 | HO6 | 122.7° | 133.5° |
| O2 | C7 | H71 | H72 | 120.0° | 120.5° |
| O2 | C7 | H71 | H73 | 120.0° | 119.4° |
| O2 | C7 | H72 | H73 | 120.0° | 119.3° |
| H71 | C7 | H72 | H73 | 120.0° | 120.2° |






