01Z
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O32 | C14 | doub | 1.21Å | 1.22Å | |
| C14 | C5 | sing | 1.51Å | 1.54Å | |
| C5 | O21 | sing | 1.43Å | 1.40Å | |
| O21 | C44 | sing | 1.43Å | 1.39Å | |
| C44 | C49 | sing | 1.53Å | 1.52Å | |
| C44 | C45 | sing | 1.53Å | 1.47Å | |
| C49 | C48 | sing | 1.53Å | 1.51Å | |
| C48 | C47 | sing | 1.53Å | 1.48Å | |
| C47 | C46 | sing | 1.53Å | 1.50Å | |
| C46 | C45 | sing | 1.53Å | 1.49Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H5A | sing | 1.09Å | 1.10Å | |
| C44 | H44 | sing | 1.09Å | 1.10Å | |
| C49 | H49 | sing | 1.09Å | 1.10Å | |
| C49 | H49A | sing | 1.09Å | 1.10Å | |
| C48 | H48 | sing | 1.09Å | 1.10Å | |
| C48 | H48A | sing | 1.09Å | 1.10Å | |
| C47 | H47 | sing | 1.09Å | 1.10Å | |
| C47 | H47A | sing | 1.09Å | 1.10Å | |
| C46 | H46 | sing | 1.09Å | 1.10Å | |
| C46 | H46A | sing | 1.09Å | 1.10Å | |
| C45 | H45 | sing | 1.09Å | 1.10Å | |
| C45 | H45A | sing | 1.09Å | 1.10Å | |
| C14 | OXT | sing | 1.34Å | 32.50Å | |
| OXT | HXT | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O32 | C14 | C5 | 112.4° | 120.0° |
| O32 | C14 | OXT | 49.2° | 120.0° |
| C14 | C5 | O21 | 121.2° | 109.5° |
| C14 | C5 | H5 | 105.8° | 109.5° |
| C14 | C5 | H5A | 105.7° | 109.4° |
| C5 | C14 | OXT | 156.4° | 120.0° |
| C5 | O21 | C44 | 127.0° | 114.0° |
| O21 | C5 | H5 | 105.7° | 109.5° |
| O21 | C5 | H5A | 105.8° | 109.4° |
| O21 | C44 | C49 | 114.2° | 109.5° |
| O21 | C44 | C45 | 107.2° | 109.5° |
| O21 | C44 | H44 | 106.4° | 109.5° |
| C49 | C44 | C45 | 104.6° | 109.5° |
| C44 | C49 | C48 | 117.5° | 109.5° |
| C49 | C44 | H44 | 108.9° | 109.5° |
| C44 | C49 | H49 | 106.9° | 109.5° |
| C44 | C49 | H49A | 106.9° | 109.5° |
| C44 | C45 | C46 | 113.9° | 109.5° |
| C45 | C44 | H44 | 115.8° | 109.5° |
| C44 | C45 | H45 | 108.0° | 109.5° |
| C44 | C45 | H45A | 108.0° | 109.5° |
| C49 | C48 | C47 | 102.9° | 109.5° |
| C48 | C49 | H49 | 106.9° | 109.5° |
| C48 | C49 | H49A | 106.9° | 109.5° |
| C49 | C48 | H48 | 111.7° | 109.5° |
| C49 | C48 | H48A | 111.7° | 109.5° |
| C48 | C47 | C46 | 112.8° | 109.5° |
| C47 | C48 | H48 | 111.8° | 109.5° |
| C47 | C48 | H48A | 111.7° | 109.4° |
| C48 | C47 | H47 | 108.4° | 109.4° |
| C48 | C47 | H47A | 108.4° | 109.5° |
| C47 | C46 | C45 | 110.0° | 109.5° |
| C46 | C47 | H47 | 108.4° | 109.5° |
| C46 | C47 | H47A | 108.3° | 109.5° |
| C47 | C46 | H46 | 109.3° | 109.4° |
| C47 | C46 | H46A | 109.3° | 109.5° |
| C45 | C46 | H46 | 109.3° | 109.5° |
| C45 | C46 | H46A | 109.3° | 109.5° |
| C46 | C45 | H45 | 108.0° | 109.4° |
| C46 | C45 | H45A | 108.0° | 109.5° |
| H5 | C5 | H5A | 112.9° | 109.5° |
| H49 | C49 | H49A | 111.9° | 109.4° |
| H48 | C48 | H48A | 107.1° | 109.5° |
| H47 | C47 | H47A | 110.6° | 109.4° |
| H46 | C46 | H46A | 109.7° | 109.5° |
| H45 | C45 | H45A | 110.9° | 109.5° |
| C14 | OXT | HXT | 90.0° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O32 | C14 | C5 | OXT | 34.7° | 179.7° |
| O32 | C14 | C5 | O21 | 99.5° | 0.0° |
| O32 | C14 | C5 | H5 | 20.5° | 120.0° |
| O32 | C14 | C5 | H5A | 140.5° | 120.0° |
| O32 | C14 | OXT | HXT | 90.0° | 0.0° |
| C14 | C5 | O21 | H5 | 120.0° | 120.0° |
| C14 | C5 | O21 | H5A | 120.0° | 120.0° |
| C14 | C5 | O21 | C44 | 19.0° | 180.0° |
| C14 | C5 | H5 | H5A | 115.2° | 120.0° |
| C5 | C14 | OXT | HXT | 90.0° | 179.7° |
| C5 | O21 | C44 | C49 | 143.6° | 150.0° |
| C5 | O21 | C44 | C45 | 101.0° | 90.0° |
| O21 | C5 | H5 | H5A | 115.2° | 120.0° |
| C5 | O21 | C44 | H44 | 23.4° | 30.0° |
| O21 | C5 | C14 | OXT | 134.1° | 179.7° |
| O21 | C44 | C49 | C45 | 116.8° | 120.0° |
| O21 | C44 | C49 | H44 | 118.8° | 120.0° |
| O21 | C44 | C45 | H44 | 118.6° | 120.0° |
| O21 | C44 | C49 | C48 | 175.8° | 180.0° |
| O21 | C44 | C45 | C46 | 175.1° | 180.0° |
| C44 | O21 | C5 | H5 | 101.0° | 60.0° |
| C44 | O21 | C5 | H5A | 139.0° | 60.0° |
| O21 | C44 | C49 | H49 | 55.8° | 60.0° |
| O21 | C44 | C49 | H49A | 64.2° | 60.0° |
| O21 | C44 | C45 | H45 | 64.9° | 60.0° |
| O21 | C44 | C45 | H45A | 55.1° | 60.0° |
| C49 | C44 | C45 | H44 | 119.9° | 120.0° |
| C44 | C49 | C48 | H49 | 120.0° | 120.0° |
| C44 | C49 | C48 | H49A | 120.0° | 120.1° |
| C44 | C49 | C48 | C47 | 61.1° | 60.0° |
| C49 | C44 | C45 | C46 | 53.5° | 60.0° |
| C44 | C49 | H49 | H49A | 116.7° | 120.0° |
| C44 | C49 | C48 | H48 | 178.9° | 180.0° |
| C44 | C49 | C48 | H48A | 58.9° | 60.0° |
| C49 | C44 | C45 | H45 | 173.5° | 180.0° |
| C49 | C44 | C45 | H45A | 66.4° | 60.0° |
| C45 | C44 | C49 | C48 | 59.0° | 60.0° |
| C44 | C45 | C46 | C47 | 56.8° | 60.0° |
| C44 | C45 | C46 | H45 | 120.0° | 120.0° |
| C44 | C45 | C46 | H45A | 120.0° | 120.0° |
| C45 | C44 | C49 | H49 | 61.0° | 60.0° |
| C45 | C44 | C49 | H49A | 179.0° | 180.0° |
| C44 | C45 | C46 | H46 | 176.8° | 180.0° |
| C44 | C45 | C46 | H46A | 63.2° | 60.0° |
| C44 | C45 | H45 | H45A | 118.2° | 120.0° |
| C49 | C48 | C47 | H48 | 120.0° | 120.1° |
| C49 | C48 | C47 | H48A | 120.0° | 120.0° |
| C49 | C48 | C47 | C46 | 58.4° | 59.9° |
| C48 | C49 | C44 | H44 | 65.4° | 60.0° |
| C48 | C49 | H49 | H49A | 116.7° | 120.0° |
| C49 | C48 | H48 | H48A | 122.6° | 120.0° |
| C49 | C48 | C47 | H47 | 61.6° | 60.0° |
| C49 | C48 | C47 | H47A | 178.3° | 180.0° |
| C48 | C47 | C46 | H47 | 120.0° | 120.0° |
| C48 | C47 | C46 | H47A | 120.0° | 120.1° |
| C48 | C47 | C46 | C45 | 59.6° | 60.0° |
| C47 | C48 | C49 | H49 | 58.9° | 60.1° |
| C47 | C48 | C49 | H49A | 178.9° | 180.0° |
| C47 | C48 | H48 | H48A | 122.7° | 120.0° |
| C48 | C47 | H47 | H47A | 118.7° | 120.0° |
| C48 | C47 | C46 | H46 | 179.6° | 180.0° |
| C48 | C47 | C46 | H46A | 60.4° | 60.1° |
| C47 | C46 | C45 | H46 | 120.0° | 119.9° |
| C47 | C46 | C45 | H46A | 120.0° | 120.0° |
| C46 | C47 | C48 | H48 | 178.4° | 180.0° |
| C46 | C47 | C48 | H48A | 61.6° | 60.0° |
| C46 | C47 | H47 | H47A | 118.6° | 120.0° |
| C47 | C46 | H46 | H46A | 119.8° | 120.0° |
| C47 | C46 | C45 | H45 | 176.8° | 180.0° |
| C47 | C46 | C45 | H45A | 63.2° | 60.0° |
| C46 | C45 | C44 | H44 | 66.3° | 60.0° |
| C45 | C46 | C47 | H47 | 60.4° | 60.0° |
| C45 | C46 | C47 | H47A | 179.6° | 180.0° |
| C45 | C46 | H46 | H46A | 119.8° | 120.1° |
| C46 | C45 | H45 | H45A | 118.1° | 120.0° |
| H5 | C5 | C14 | OXT | 14.1° | 59.7° |
| H5A | C5 | C14 | OXT | 105.8° | 60.3° |
| H44 | C44 | C49 | H49 | 174.6° | NaN° |
| H44 | C44 | C49 | H49A | 54.6° | 60.0° |
| H44 | C44 | C45 | H45 | 53.7° | 60.0° |
| H44 | C44 | C45 | H45A | 173.7° | 180.0° |
| H49 | C49 | C48 | H48 | 61.1° | 60.0° |
| H49 | C49 | C48 | H48A | 178.9° | 180.0° |
| H49A | C49 | C48 | H48 | 58.9° | 59.9° |
| H49A | C49 | C48 | H48A | 61.1° | 60.1° |
| H48 | C48 | C47 | H47 | 58.4° | 60.0° |
| H48 | C48 | C47 | H47A | 61.7° | 59.9° |
| H48A | C48 | C47 | H47 | 178.4° | 180.0° |
| H48A | C48 | C47 | H47A | 58.3° | 60.0° |
| H47 | C47 | C46 | H46 | 59.6° | 60.0° |
| H47 | C47 | C46 | H46A | 179.7° | 180.0° |
| H47A | C47 | C46 | H46 | 60.4° | 60.0° |
| H47A | C47 | C46 | H46A | 59.7° | 60.0° |
| H46 | C46 | C45 | H45 | 63.2° | 60.1° |
| H46 | C46 | C45 | H45A | 56.8° | 59.9° |
| H46A | C46 | C45 | H45 | 56.8° | 60.0° |
| H46A | C46 | C45 | H45A | 176.8° | 180.0° |
