1Y8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C4 | C5 | sing | 1.53Å | 1.49Å | |
| C4 | O6 | sing | 1.43Å | 1.38Å | |
| C5 | AS1 | sing | 1.99Å | 1.96Å | |
| C6 | AS1 | sing | 1.99Å | 1.76Å | |
| C7 | AS1 | sing | 1.99Å | 1.75Å | |
| C8 | AS1 | sing | 1.99Å | 1.75Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H8 | sing | 1.09Å | 1.10Å | |
| C7 | H9 | sing | 1.09Å | 1.10Å | |
| C7 | H10 | sing | 1.09Å | 1.10Å | |
| C8 | H11 | sing | 1.09Å | 1.10Å | |
| C8 | H12 | sing | 1.09Å | 1.10Å | |
| C8 | H13 | sing | 1.09Å | 1.10Å | |
| O6 | H14 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C5 | C4 | O6 | 117.0° | 109.5° |
| C4 | C5 | AS1 | 115.5° | 109.4° |
| C5 | C4 | H1 | 107.5° | 109.5° |
| C5 | C4 | H2 | 107.5° | 109.5° |
| C4 | C5 | H3 | 107.9° | 109.5° |
| C4 | C5 | H4 | 107.9° | 109.4° |
| O6 | C4 | H1 | 107.5° | 109.5° |
| O6 | C4 | H2 | 107.6° | 109.4° |
| C4 | O6 | H14 | 109.5° | 114.0° |
| C5 | AS1 | C6 | 121.0° | 109.5° |
| C5 | AS1 | C7 | 123.8° | 109.4° |
| C5 | AS1 | C8 | 100.5° | 109.5° |
| AS1 | C5 | H3 | 107.9° | 109.5° |
| AS1 | C5 | H4 | 107.9° | 109.4° |
| C6 | AS1 | C7 | 111.8° | 109.5° |
| C6 | AS1 | C8 | 94.0° | 109.5° |
| AS1 | C6 | H5 | 109.5° | 109.5° |
| AS1 | C6 | H6 | 109.5° | 109.5° |
| AS1 | C6 | H7 | 109.5° | 109.5° |
| C7 | AS1 | C8 | 93.7° | 109.5° |
| AS1 | C7 | H8 | 109.5° | 109.5° |
| AS1 | C7 | H9 | 109.5° | 109.4° |
| AS1 | C7 | H10 | 109.4° | 109.4° |
| AS1 | C8 | H11 | 109.5° | 109.5° |
| AS1 | C8 | H12 | 109.4° | 109.5° |
| AS1 | C8 | H13 | 109.5° | 109.5° |
| H1 | C4 | H2 | 109.5° | 109.5° |
| H3 | C5 | H4 | 109.5° | 109.5° |
| H5 | C6 | H6 | 109.4° | 109.4° |
| H5 | C6 | H7 | 109.5° | 109.5° |
| H6 | C6 | H7 | 109.5° | 109.4° |
| H8 | C7 | H9 | 109.5° | 109.5° |
| H8 | C7 | H10 | 109.5° | 109.5° |
| H9 | C7 | H10 | 109.5° | 109.4° |
| H11 | C8 | H12 | 109.5° | 109.4° |
| H11 | C8 | H13 | 109.5° | 109.4° |
| H12 | C8 | H13 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C5 | C4 | O6 | H1 | 121.1° | 120.0° |
| C5 | C4 | O6 | H2 | 121.1° | 120.0° |
| C4 | C5 | AS1 | H3 | 120.9° | 120.0° |
| C4 | C5 | AS1 | H4 | 120.9° | 119.9° |
| C4 | C5 | AS1 | C6 | 145.2° | 60.0° |
| C4 | C5 | AS1 | C7 | 57.6° | 180.0° |
| C4 | C5 | AS1 | C8 | 44.1° | 60.0° |
| C5 | C4 | H1 | H2 | 116.6° | 120.0° |
| C4 | C5 | H3 | H4 | 117.2° | 120.0° |
| C5 | C4 | O6 | H14 | 180.0° | 180.0° |
| O6 | C4 | C5 | AS1 | 64.4° | 180.0° |
| O6 | C4 | H1 | H2 | 116.6° | 120.0° |
| O6 | C4 | C5 | H3 | 56.5° | 60.0° |
| O6 | C4 | C5 | H4 | 174.7° | 60.1° |
| C5 | AS1 | C6 | C7 | 159.7° | 120.0° |
| C5 | AS1 | C6 | C8 | 104.7° | 120.0° |
| C5 | AS1 | C7 | C8 | 105.2° | 120.0° |
| AS1 | C5 | C4 | H1 | 56.7° | 60.0° |
| AS1 | C5 | C4 | H2 | 174.5° | 60.0° |
| AS1 | C5 | H3 | H4 | 117.2° | 120.0° |
| C5 | AS1 | C6 | H5 | 180.0° | 60.0° |
| C5 | AS1 | C6 | H6 | 60.0° | 180.0° |
| C5 | AS1 | C6 | H7 | 60.0° | 60.1° |
| C5 | AS1 | C7 | H8 | 180.0° | 60.0° |
| C5 | AS1 | C7 | H9 | 60.0° | 179.9° |
| C5 | AS1 | C7 | H10 | 60.0° | 60.0° |
| C5 | AS1 | C8 | H11 | 180.0° | 60.0° |
| C5 | AS1 | C8 | H12 | 60.0° | 180.0° |
| C5 | AS1 | C8 | H13 | 60.0° | 60.0° |
| C6 | AS1 | C7 | C8 | 95.8° | 120.0° |
| C6 | AS1 | C5 | H3 | 93.9° | 60.0° |
| C6 | AS1 | C5 | H4 | 24.4° | 180.0° |
| AS1 | C6 | H5 | H6 | 120.0° | 120.0° |
| AS1 | C6 | H5 | H7 | 120.0° | 120.1° |
| AS1 | C6 | H6 | H7 | 120.0° | 120.0° |
| C6 | AS1 | C7 | H8 | 21.0° | 180.0° |
| C6 | AS1 | C7 | H9 | 141.0° | 60.0° |
| C6 | AS1 | C7 | H10 | 99.0° | 59.9° |
| C6 | AS1 | C8 | H11 | 57.5° | 60.0° |
| C6 | AS1 | C8 | H12 | 62.5° | 60.0° |
| C6 | AS1 | C8 | H13 | 177.5° | 180.0° |
| C7 | AS1 | C5 | H3 | 63.3° | 60.0° |
| C7 | AS1 | C5 | H4 | 178.5° | 60.0° |
| C7 | AS1 | C6 | H5 | 20.3° | 60.0° |
| C7 | AS1 | C6 | H6 | 99.7° | 60.0° |
| C7 | AS1 | C6 | H7 | 140.3° | 180.0° |
| AS1 | C7 | H8 | H9 | 120.0° | 120.0° |
| AS1 | C7 | H8 | H10 | 120.0° | 120.0° |
| AS1 | C7 | H9 | H10 | 120.0° | 119.9° |
| C7 | AS1 | C8 | H11 | 54.6° | 180.0° |
| C7 | AS1 | C8 | H12 | 174.7° | 60.0° |
| C7 | AS1 | C8 | H13 | 65.4° | 60.0° |
| C8 | AS1 | C5 | H3 | 165.0° | 180.0° |
| C8 | AS1 | C5 | H4 | 76.7° | 60.0° |
| C8 | AS1 | C6 | H5 | 75.3° | 180.0° |
| C8 | AS1 | C6 | H6 | 164.7° | 60.0° |
| C8 | AS1 | C6 | H7 | 44.7° | 60.0° |
| C8 | AS1 | C7 | H8 | 74.8° | 60.0° |
| C8 | AS1 | C7 | H9 | 45.2° | 60.0° |
| C8 | AS1 | C7 | H10 | 165.2° | 179.9° |
| AS1 | C8 | H11 | H12 | 120.0° | 120.0° |
| AS1 | C8 | H11 | H13 | 120.0° | 120.0° |
| AS1 | C8 | H12 | H13 | 120.0° | 120.0° |
| H1 | C4 | C5 | H3 | 177.5° | 60.0° |
| H1 | C4 | C5 | H4 | 64.2° | 179.9° |
| H1 | C4 | O6 | H14 | 58.9° | 60.0° |
| H2 | C4 | C5 | H3 | 64.6° | 180.0° |
| H2 | C4 | C5 | H4 | 53.6° | 59.9° |
| H2 | C4 | O6 | H14 | 58.9° | 60.0° |
| H5 | C6 | H6 | H7 | 120.0° | 119.9° |
| H8 | C7 | H9 | H10 | 120.0° | 120.1° |
| H11 | C8 | H12 | H13 | 120.0° | 119.9° |
