7ZO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O17 | C11 | doub | 1.21Å | 1.23Å | |
| C11 | C12 | sing | 1.51Å | 1.51Å | |
| C11 | N15 | sing | 1.34Å | 1.37Å | |
| C12 | C6 | sing | 1.51Å | 1.50Å | |
| N15 | C7 | sing | 1.40Å | 1.38Å | |
| C6 | C7 | doub | 1.39Å | 1.37Å | Aromatic |
| C6 | C3 | sing | 1.38Å | 1.37Å | Aromatic |
| C7 | C1 | sing | 1.39Å | 1.37Å | Aromatic |
| C3 | C8 | doub | 1.39Å | 1.38Å | Aromatic |
| C1 | C2 | doub | 1.38Å | 1.39Å | Aromatic |
| C8 | C2 | sing | 1.39Å | 1.38Å | Aromatic |
| C8 | N16 | sing | 1.40Å | 1.39Å | |
| N16 | C10 | sing | 1.39Å | 1.40Å | |
| C10 | N14 | doub | 1.33Å | 1.33Å | Aromatic |
| C10 | C9 | sing | 1.40Å | 1.38Å | Aromatic |
| CL1 | C9 | sing | 1.74Å | 1.73Å | |
| N14 | C5 | sing | 1.32Å | 1.34Å | Aromatic |
| C9 | C4 | doub | 1.38Å | 1.38Å | Aromatic |
| C5 | N13 | doub | 1.32Å | 1.33Å | Aromatic |
| C4 | N13 | sing | 1.33Å | 1.34Å | Aromatic |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H2 | sing | 1.08Å | 1.08Å | |
| C1 | H3 | sing | 1.08Å | 1.08Å | |
| C2 | H4 | sing | 1.08Å | 1.08Å | |
| C3 | H5 | sing | 1.08Å | 1.08Å | |
| C12 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| N15 | H8 | sing | 0.97Å | 1.00Å | |
| N16 | H9 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O17 | C11 | C12 | 125.5° | 126.4° |
| O17 | C11 | N15 | 127.8° | 126.4° |
| C12 | C11 | N15 | 106.7° | 107.2° |
| C11 | C12 | C6 | 102.5° | 104.1° |
| C11 | C12 | H6 | 111.2° | 110.5° |
| C11 | C12 | H7 | 111.2° | 110.5° |
| C11 | N15 | C7 | 112.4° | 112.2° |
| C11 | N15 | H8 | 123.8° | 123.9° |
| C12 | C6 | C7 | 109.7° | 106.4° |
| C12 | C6 | C3 | 129.2° | 132.7° |
| C6 | C12 | H6 | 111.2° | 110.3° |
| C6 | C12 | H7 | 111.2° | 110.8° |
| N15 | C7 | C6 | 108.6° | 110.2° |
| N15 | C7 | C1 | 129.3° | 130.7° |
| C7 | N15 | H8 | 123.8° | 123.9° |
| C7 | C6 | C3 | 121.1° | 120.9° |
| C6 | C7 | C1 | 122.1° | 119.1° |
| C6 | C3 | C8 | 117.9° | 119.9° |
| C6 | C3 | H5 | 121.0° | 120.1° |
| C7 | C1 | C2 | 117.2° | 120.3° |
| C7 | C1 | H3 | 121.4° | 119.9° |
| C3 | C8 | C2 | 120.9° | 119.7° |
| C3 | C8 | N16 | 118.8° | 120.2° |
| C8 | C3 | H5 | 121.0° | 120.1° |
| C1 | C2 | C8 | 120.8° | 120.3° |
| C2 | C1 | H3 | 121.4° | 119.9° |
| C1 | C2 | H4 | 119.6° | 119.9° |
| C2 | C8 | N16 | 120.2° | 120.2° |
| C8 | C2 | H4 | 119.6° | 119.8° |
| C8 | N16 | C10 | 123.2° | 120.0° |
| C8 | N16 | H9 | 118.4° | 120.0° |
| N16 | C10 | N14 | 117.6° | 120.6° |
| N16 | C10 | C9 | 122.0° | 120.5° |
| C10 | N16 | H9 | 118.4° | 120.0° |
| N14 | C10 | C9 | 120.4° | 118.9° |
| C10 | N14 | C5 | 116.9° | 120.7° |
| C10 | C9 | CL1 | 124.4° | 120.8° |
| C10 | C9 | C4 | 117.7° | 118.3° |
| CL1 | C9 | C4 | 117.8° | 120.9° |
| N14 | C5 | N13 | 127.5° | 121.9° |
| N14 | C5 | H2 | 116.2° | 119.0° |
| C9 | C4 | N13 | 123.2° | 119.2° |
| C9 | C4 | H1 | 118.4° | 120.4° |
| C5 | N13 | C4 | 114.2° | 121.0° |
| N13 | C5 | H2 | 116.3° | 119.1° |
| N13 | C4 | H1 | 118.4° | 120.4° |
| H6 | C12 | H7 | 109.5° | 110.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O17 | C11 | C12 | N15 | 179.2° | 179.8° |
| O17 | C11 | C12 | C6 | 176.8° | 180.0° |
| O17 | C11 | N15 | C7 | 176.3° | 179.8° |
| O17 | C11 | C12 | H6 | 64.3° | 61.6° |
| O17 | C11 | C12 | H7 | 58.0° | 61.1° |
| O17 | C11 | N15 | H8 | 3.7° | 0.2° |
| C11 | C12 | C6 | H6 | 118.9° | 118.5° |
| C11 | C12 | C6 | H7 | 118.9° | 118.7° |
| C12 | C11 | N15 | C7 | 2.8° | 0.4° |
| C11 | C12 | C6 | C7 | 1.2° | 0.0° |
| C11 | C12 | C6 | C3 | 178.2° | 179.7° |
| C11 | C12 | H6 | H7 | 123.2° | 122.7° |
| C12 | C11 | N15 | H8 | 177.2° | 179.9° |
| N15 | C11 | C12 | C6 | 2.4° | 0.3° |
| C11 | N15 | C7 | H8 | 180.0° | 179.7° |
| C11 | N15 | C7 | C6 | 2.1° | 0.4° |
| C11 | N15 | C7 | C1 | 178.2° | 179.6° |
| N15 | C11 | C12 | H6 | 116.5° | 118.6° |
| N15 | C11 | C12 | H7 | 121.2° | 118.7° |
| C12 | C6 | C7 | N15 | 0.4° | 0.2° |
| C12 | C6 | C7 | C3 | 179.4° | 179.8° |
| C12 | C6 | C7 | C1 | 179.9° | 179.8° |
| C12 | C6 | C3 | C8 | 179.9° | 179.7° |
| C12 | C6 | C3 | H5 | 0.1° | 0.3° |
| C6 | C12 | H6 | H7 | 123.3° | 122.9° |
| N15 | C7 | C6 | C1 | 179.7° | 180.0° |
| N15 | C7 | C6 | C3 | 179.8° | 180.0° |
| N15 | C7 | C1 | C2 | 179.9° | 179.9° |
| N15 | C7 | C1 | H3 | 0.1° | 0.0° |
| C7 | C6 | C3 | C8 | 0.6° | 0.0° |
| C6 | C7 | C1 | C2 | 0.4° | 0.1° |
| C6 | C7 | C1 | H3 | 179.6° | 180.0° |
| C7 | C6 | C3 | H5 | 179.4° | 180.0° |
| C7 | C6 | C12 | H6 | 117.7° | 118.5° |
| C7 | C6 | C12 | H7 | 120.1° | 118.7° |
| C6 | C7 | N15 | H8 | 177.9° | 179.9° |
| C3 | C6 | C7 | C1 | 0.4° | 0.0° |
| C6 | C3 | C8 | H5 | 180.0° | 180.0° |
| C6 | C3 | C8 | C2 | 0.8° | 0.1° |
| C6 | C3 | C8 | N16 | 179.0° | 180.0° |
| C3 | C6 | C12 | H6 | 63.0° | 61.2° |
| C3 | C6 | C12 | H7 | 59.3° | 61.5° |
| C7 | C1 | C2 | H3 | 180.0° | 179.9° |
| C7 | C1 | C2 | C8 | 0.6° | 0.1° |
| C7 | C1 | C2 | H4 | 179.4° | 180.0° |
| C1 | C7 | N15 | H8 | 1.8° | 0.1° |
| C3 | C8 | C2 | C1 | 0.8° | 0.1° |
| C3 | C8 | C2 | N16 | 178.1° | 179.9° |
| C3 | C8 | N16 | C10 | 122.2° | 33.8° |
| C3 | C8 | C2 | H4 | 179.2° | 180.0° |
| C3 | C8 | N16 | H9 | 57.8° | 146.2° |
| C1 | C2 | C8 | H4 | 180.0° | 179.9° |
| C1 | C2 | C8 | N16 | 179.0° | 180.0° |
| C2 | C8 | N16 | C10 | 56.0° | 146.3° |
| C8 | C2 | C1 | H3 | 179.4° | 180.0° |
| C2 | C8 | C3 | H5 | 179.2° | 180.0° |
| C2 | C8 | N16 | H9 | 124.0° | 33.8° |
| C8 | N16 | C10 | H9 | 180.0° | 179.9° |
| C8 | N16 | C10 | N14 | 0.2° | 6.8° |
| C8 | N16 | C10 | C9 | 179.6° | 174.0° |
| N16 | C8 | C2 | H4 | 1.1° | 0.1° |
| N16 | C8 | C3 | H5 | 1.1° | 0.1° |
| N16 | C10 | N14 | C9 | 179.5° | 179.1° |
| N16 | C10 | C9 | CL1 | 1.4° | 0.3° |
| N16 | C10 | N14 | C5 | 178.9° | 180.0° |
| N16 | C10 | C9 | C4 | 179.2° | 179.7° |
| N14 | C10 | C9 | CL1 | 179.2° | 179.5° |
| N14 | C10 | C9 | C4 | 0.3° | 0.5° |
| C10 | N14 | C5 | N13 | 0.2° | 0.5° |
| C10 | N14 | C5 | H2 | 179.8° | 179.4° |
| N14 | C10 | N16 | H9 | 179.8° | 173.2° |
| C10 | C9 | CL1 | C4 | 179.5° | 180.0° |
| C9 | C10 | N14 | C5 | 0.6° | 0.8° |
| C10 | C9 | C4 | N13 | 0.4° | 0.0° |
| C10 | C9 | C4 | H1 | 179.6° | 179.7° |
| C9 | C10 | N16 | H9 | 0.3° | 5.9° |
| CL1 | C9 | C4 | N13 | 179.9° | 180.0° |
| CL1 | C9 | C4 | H1 | 0.1° | 0.3° |
| N14 | C5 | N13 | H2 | 180.0° | 180.0° |
| N14 | C5 | N13 | C4 | 0.5° | 0.1° |
| C9 | C4 | N13 | C5 | 0.7° | 0.3° |
| C9 | C4 | N13 | H1 | 180.0° | 179.6° |
| C5 | N13 | C4 | H1 | 179.3° | 180.0° |
| C4 | N13 | C5 | H2 | 179.5° | 180.0° |
| H3 | C1 | C2 | H4 | 0.6° | 0.1° |
