A1L24
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O25 | C22 | doub | 1.21Å | 1.27Å | |
| N31 | N30 | sing | 1.29Å | 1.35Å | Aromatic |
| N31 | C27 | doub | 1.31Å | 1.37Å | Aromatic |
| N30 | N29 | doub | 1.29Å | 1.32Å | Aromatic |
| C22 | C21 | sing | 1.51Å | 1.53Å | |
| C22 | O24 | sing | 1.34Å | 1.27Å | |
| C23 | C21 | sing | 1.53Å | 1.52Å | |
| C23 | C26 | sing | 1.53Å | 1.52Å | |
| C21 | N20 | sing | 1.47Å | 1.44Å | |
| C27 | C26 | sing | 1.51Å | 1.53Å | |
| C27 | N28 | sing | 1.35Å | 1.37Å | Aromatic |
| N29 | N28 | sing | 1.29Å | 1.35Å | Aromatic |
| N20 | C18 | sing | 1.35Å | 1.44Å | |
| O19 | C18 | doub | 1.22Å | 1.19Å | |
| C18 | C15 | sing | 1.48Å | 1.52Å | |
| C15 | C16 | sing | 1.40Å | 1.38Å | Aromatic |
| C15 | C14 | doub | 1.40Å | 1.38Å | Aromatic |
| C16 | C17 | doub | 1.38Å | 1.38Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C17 | C10 | sing | 1.39Å | 1.38Å | Aromatic |
| C17 | CL32 | sing | 1.74Å | 1.79Å | |
| C13 | C10 | doub | 1.39Å | 1.38Å | Aromatic |
| C10 | N09 | sing | 1.40Å | 1.45Å | |
| N09 | C08 | sing | 1.35Å | 1.44Å | |
| O12 | C08 | doub | 1.22Å | 1.18Å | |
| C08 | N07 | sing | 1.35Å | 1.44Å | |
| N07 | C05 | sing | 1.41Å | 1.44Å | |
| O33 | C06 | doub | 1.22Å | 1.20Å | |
| C06 | C05 | sing | 1.40Å | 1.39Å | |
| C06 | N01 | sing | 1.35Å | 1.33Å | |
| C05 | C04 | doub | 1.39Å | 1.38Å | |
| N01 | C02 | sing | 1.36Å | 1.32Å | |
| C04 | N11 | sing | 1.38Å | 1.46Å | |
| C04 | N03 | sing | 1.34Å | 1.32Å | |
| C02 | N03 | doub | 1.32Å | 1.32Å | |
| C02 | N34 | sing | 1.37Å | 1.46Å | |
| C13 | H1 | sing | 1.08Å | 1.08Å | |
| C21 | H2 | sing | 1.09Å | 1.10Å | |
| C26 | H3 | sing | 1.09Å | 1.10Å | |
| C26 | H4 | sing | 1.09Å | 1.10Å | |
| C14 | H6 | sing | 1.08Å | 1.08Å | |
| C16 | H7 | sing | 1.08Å | 1.08Å | |
| C23 | H8 | sing | 1.09Å | 1.10Å | |
| C23 | H9 | sing | 1.09Å | 1.10Å | |
| N07 | H10 | sing | 0.97Å | 1.00Å | |
| N09 | H11 | sing | 0.97Å | 1.00Å | |
| N11 | H12 | sing | 0.97Å | 1.00Å | |
| N11 | H13 | sing | 0.97Å | 1.00Å | |
| N20 | H14 | sing | 0.97Å | 1.00Å | |
| N28 | H15 | sing | 0.97Å | 1.00Å | |
| N34 | H16 | sing | 0.97Å | 1.00Å | |
| N34 | H17 | sing | 0.97Å | 1.00Å | |
| O24 | H18 | sing | 0.97Å | 0.95Å | |
| N01 | H5 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O25 | C22 | C21 | 119.8° | 120.0° |
| O25 | C22 | O24 | 121.5° | 120.0° |
| N30 | N31 | C27 | 107.0° | 108.0° |
| N31 | N30 | N29 | 109.7° | 109.4° |
| N31 | C27 | C26 | 126.6° | 126.7° |
| N31 | C27 | N28 | 107.2° | 106.6° |
| N30 | N29 | N28 | 108.3° | 108.7° |
| C21 | C22 | O24 | 118.7° | 120.0° |
| C22 | C21 | C23 | 109.9° | 109.5° |
| C22 | C21 | N20 | 109.7° | 109.5° |
| C22 | C21 | H2 | 109.9° | 109.5° |
| C22 | O24 | H18 | 109.5° | 117.0° |
| C21 | C23 | C26 | 109.7° | 109.5° |
| C23 | C21 | N20 | 106.2° | 109.4° |
| C23 | C21 | H2 | 110.0° | 109.4° |
| C21 | C23 | H8 | 109.4° | 109.5° |
| C21 | C23 | H9 | 109.4° | 109.5° |
| C23 | C26 | C27 | 112.3° | 109.5° |
| C23 | C26 | H3 | 108.8° | 109.5° |
| C23 | C26 | H4 | 108.8° | 109.5° |
| C26 | C23 | H8 | 109.4° | 109.5° |
| C26 | C23 | H9 | 109.4° | 109.4° |
| C21 | N20 | C18 | 118.1° | 120.0° |
| N20 | C21 | H2 | 111.1° | 109.5° |
| C21 | N20 | H14 | 121.0° | 120.0° |
| C26 | C27 | N28 | 126.2° | 126.7° |
| C27 | C26 | H3 | 108.8° | 109.5° |
| C27 | C26 | H4 | 108.8° | 109.5° |
| C27 | N28 | N29 | 107.8° | 107.2° |
| C27 | N28 | H15 | 126.1° | 126.4° |
| N29 | N28 | H15 | 126.1° | 126.4° |
| N20 | C18 | O19 | 121.0° | 120.0° |
| N20 | C18 | C15 | 117.0° | 120.0° |
| C18 | N20 | H14 | 120.9° | 120.0° |
| O19 | C18 | C15 | 121.9° | 120.0° |
| C18 | C15 | C16 | 118.9° | 120.0° |
| C18 | C15 | C14 | 120.7° | 120.1° |
| C16 | C15 | C14 | 120.4° | 119.9° |
| C15 | C16 | C17 | 119.3° | 119.9° |
| C15 | C16 | H7 | 120.3° | 120.1° |
| C15 | C14 | C13 | 119.9° | 119.9° |
| C15 | C14 | H6 | 120.0° | 120.0° |
| C16 | C17 | C10 | 120.6° | 120.0° |
| C16 | C17 | CL32 | 120.2° | 119.9° |
| C17 | C16 | H7 | 120.3° | 120.0° |
| C14 | C13 | C10 | 119.9° | 120.1° |
| C14 | C13 | H1 | 120.0° | 119.9° |
| C13 | C14 | H6 | 120.1° | 120.0° |
| C10 | C17 | CL32 | 119.2° | 120.0° |
| C17 | C10 | C13 | 119.7° | 120.2° |
| C17 | C10 | N09 | 118.4° | 119.9° |
| C13 | C10 | N09 | 121.5° | 119.9° |
| C10 | C13 | H1 | 120.0° | 120.0° |
| C10 | N09 | C08 | 127.1° | 120.0° |
| C10 | N09 | H11 | 116.5° | 120.0° |
| N09 | C08 | O12 | 123.5° | 120.0° |
| N09 | C08 | N07 | 116.4° | 120.0° |
| C08 | N09 | H11 | 116.5° | 120.0° |
| O12 | C08 | N07 | 120.1° | 119.9° |
| C08 | N07 | C05 | 118.8° | 120.1° |
| C08 | N07 | H10 | 120.6° | 120.0° |
| N07 | C05 | C06 | 119.4° | 120.7° |
| N07 | C05 | C04 | 120.8° | 120.7° |
| C05 | N07 | H10 | 120.6° | 120.0° |
| O33 | C06 | C05 | 121.9° | 120.5° |
| O33 | C06 | N01 | 121.0° | 120.6° |
| C05 | C06 | N01 | 117.1° | 118.9° |
| C06 | C05 | C04 | 119.8° | 118.6° |
| C06 | N01 | C02 | 121.4° | 120.1° |
| C06 | N01 | H5 | 119.3° | 119.9° |
| C05 | C04 | N11 | 118.6° | 120.2° |
| C05 | C04 | N03 | 119.8° | 119.7° |
| N01 | C02 | N03 | 122.5° | 121.5° |
| N01 | C02 | N34 | 118.7° | 119.3° |
| C02 | N01 | H5 | 119.3° | 119.9° |
| N11 | C04 | N03 | 121.7° | 120.2° |
| C04 | N11 | H12 | 109.5° | 120.0° |
| C04 | N11 | H13 | 109.5° | 120.0° |
| C04 | N03 | C02 | 119.5° | 121.2° |
| N03 | C02 | N34 | 118.9° | 119.3° |
| C02 | N34 | H16 | 120.0° | 120.0° |
| C02 | N34 | H17 | 120.0° | 120.0° |
| H3 | C26 | H4 | 109.5° | 109.4° |
| H8 | C23 | H9 | 109.5° | 109.5° |
| H12 | N11 | H13 | 109.4° | 119.9° |
| H16 | N34 | H17 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O25 | C22 | C21 | O24 | 179.4° | 180.0° |
| O25 | C22 | C21 | C23 | 88.1° | 120.0° |
| O25 | C22 | C21 | N20 | 155.5° | 0.0° |
| O25 | C22 | C21 | H2 | 33.1° | 120.1° |
| O25 | C22 | O24 | H18 | 0.0° | 0.1° |
| N30 | N31 | C27 | C26 | 179.8° | 179.9° |
| N30 | N31 | C27 | N28 | 0.7° | 0.3° |
| N31 | N30 | N29 | N28 | 0.1° | 0.2° |
| C27 | N31 | N30 | N29 | 0.5° | 0.3° |
| N31 | C27 | C26 | C23 | 42.9° | 55.3° |
| N31 | C27 | C26 | N28 | 179.4° | 179.7° |
| N31 | C27 | N28 | N29 | 0.6° | 0.2° |
| N31 | C27 | C26 | H3 | 163.3° | 175.3° |
| N31 | C27 | C26 | H4 | 77.5° | 64.8° |
| N31 | C27 | N28 | H15 | 179.4° | 179.8° |
| N30 | N29 | N28 | C27 | 0.4° | 0.0° |
| N30 | N29 | N28 | H15 | 179.6° | 180.0° |
| C22 | C21 | C23 | N20 | 118.5° | 120.0° |
| C22 | C21 | C23 | H2 | 121.1° | 120.0° |
| C22 | C21 | C23 | C26 | 82.4° | 175.0° |
| C22 | C21 | N20 | H2 | 121.7° | 120.0° |
| C22 | C21 | N20 | C18 | 145.3° | 85.0° |
| C22 | C21 | C23 | H8 | 37.6° | 65.0° |
| C22 | C21 | C23 | H9 | 157.6° | 55.0° |
| C22 | C21 | N20 | H14 | 34.7° | 95.0° |
| C21 | C22 | O24 | H18 | 179.3° | 180.0° |
| O24 | C22 | C21 | C23 | 91.3° | 60.0° |
| O24 | C22 | C21 | N20 | 25.1° | 180.0° |
| O24 | C22 | C21 | H2 | 147.6° | 60.0° |
| C21 | C23 | C26 | H8 | 120.0° | 120.0° |
| C21 | C23 | C26 | H9 | 120.0° | 120.0° |
| C23 | C21 | N20 | H2 | 119.6° | 120.0° |
| C21 | C23 | C26 | C27 | 161.9° | 180.0° |
| C23 | C21 | N20 | C18 | 96.0° | 155.0° |
| C21 | C23 | C26 | H3 | 77.7° | 60.0° |
| C21 | C23 | C26 | H4 | 41.5° | 60.0° |
| C21 | C23 | H8 | H9 | 119.9° | 120.0° |
| C23 | C21 | N20 | H14 | 84.0° | 25.0° |
| C26 | C23 | C21 | N20 | 36.2° | 65.0° |
| C23 | C26 | C27 | H3 | 120.4° | 120.0° |
| C23 | C26 | C27 | H4 | 120.4° | 120.0° |
| C23 | C26 | C27 | N28 | 136.5° | 125.0° |
| C26 | C23 | C21 | H2 | 156.5° | 55.0° |
| C23 | C26 | H3 | H4 | 118.7° | 120.0° |
| C26 | C23 | H8 | H9 | 119.9° | 120.0° |
| C21 | N20 | C18 | H14 | 180.0° | 180.0° |
| C21 | N20 | C18 | O19 | 1.3° | 0.0° |
| C21 | N20 | C18 | C15 | 179.3° | 180.0° |
| N20 | C21 | C23 | H8 | 156.2° | 55.1° |
| N20 | C21 | C23 | H9 | 83.9° | 175.0° |
| C26 | C27 | N28 | N29 | 179.9° | 180.0° |
| C27 | C26 | H3 | H4 | 118.7° | 120.0° |
| C27 | C26 | C23 | H8 | 41.9° | 60.0° |
| C27 | C26 | C23 | H9 | 78.0° | 60.0° |
| C26 | C27 | N28 | H15 | 0.1° | 0.0° |
| C27 | N28 | N29 | H15 | 180.0° | 180.0° |
| N28 | C27 | C26 | H3 | 16.1° | 5.0° |
| N28 | C27 | C26 | H4 | 103.0° | 115.0° |
| N20 | C18 | O19 | C15 | 177.9° | 180.0° |
| N20 | C18 | C15 | C16 | 15.8° | 180.0° |
| N20 | C18 | C15 | C14 | 163.1° | 0.3° |
| C18 | N20 | C21 | H2 | 23.6° | 35.0° |
| O19 | C18 | C15 | C16 | 166.2° | 0.0° |
| O19 | C18 | C15 | C14 | 14.9° | 179.7° |
| O19 | C18 | N20 | H14 | 178.7° | 180.0° |
| C18 | C15 | C16 | C14 | 178.9° | 179.7° |
| C18 | C15 | C16 | C17 | 179.3° | 180.0° |
| C18 | C15 | C14 | C13 | 179.4° | 180.0° |
| C18 | C15 | C14 | H6 | 0.6° | 0.3° |
| C18 | C15 | C16 | H7 | 0.7° | 0.3° |
| C15 | C18 | N20 | H14 | 0.7° | 0.0° |
| C15 | C16 | C17 | H7 | 180.0° | 179.7° |
| C16 | C15 | C14 | C13 | 0.5° | 0.3° |
| C15 | C16 | C17 | C10 | 1.6° | 0.1° |
| C15 | C16 | C17 | CL32 | 179.7° | 180.0° |
| C16 | C15 | C14 | H6 | 179.5° | 180.0° |
| C14 | C15 | C16 | C17 | 0.4° | 0.3° |
| C15 | C14 | C13 | H6 | 180.0° | 179.7° |
| C15 | C14 | C13 | C10 | 1.3° | 0.0° |
| C15 | C14 | C13 | H1 | 178.7° | 180.0° |
| C14 | C15 | C16 | H7 | 179.6° | 180.0° |
| C16 | C17 | C10 | CL32 | 178.7° | 179.9° |
| C16 | C17 | C10 | C13 | 3.4° | 0.2° |
| C16 | C17 | C10 | N09 | 176.8° | 180.0° |
| C14 | C13 | C10 | C17 | 3.3° | 0.2° |
| C14 | C13 | C10 | H1 | 180.0° | 180.0° |
| C14 | C13 | C10 | N09 | 176.5° | 180.0° |
| C17 | C10 | C13 | N09 | 173.2° | 179.8° |
| C17 | C10 | N09 | C08 | 169.7° | 148.5° |
| C17 | C10 | C13 | H1 | 176.7° | 179.7° |
| C10 | C17 | C16 | H7 | 178.5° | 179.8° |
| C17 | C10 | N09 | H11 | 10.3° | 31.5° |
| CL32 | C17 | C10 | C13 | 177.9° | 179.7° |
| CL32 | C17 | C10 | N09 | 4.5° | 0.1° |
| CL32 | C17 | C16 | H7 | 0.3° | 0.4° |
| C13 | C10 | N09 | C08 | 17.0° | 31.3° |
| C10 | C13 | C14 | H6 | 178.6° | 179.7° |
| C13 | C10 | N09 | H11 | 163.0° | 148.7° |
| C10 | N09 | C08 | H11 | 180.0° | 180.0° |
| C10 | N09 | C08 | O12 | 5.0° | 5.3° |
| C10 | N09 | C08 | N07 | 176.8° | 174.7° |
| N09 | C10 | C13 | H1 | 3.5° | 0.0° |
| N09 | C08 | O12 | N07 | 178.1° | 180.0° |
| N09 | C08 | N07 | C05 | 179.9° | 174.7° |
| N09 | C08 | N07 | H10 | 0.1° | 5.4° |
| O12 | C08 | N07 | C05 | 1.9° | 5.3° |
| O12 | C08 | N07 | H10 | 178.1° | 174.6° |
| O12 | C08 | N09 | H11 | 175.0° | 174.7° |
| C08 | N07 | C05 | H10 | 180.0° | 180.0° |
| C08 | N07 | C05 | C06 | 65.4° | 60.4° |
| C08 | N07 | C05 | C04 | 114.8° | 120.1° |
| N07 | C08 | N09 | H11 | 3.2° | 5.3° |
| N07 | C05 | C06 | O33 | 1.2° | 0.5° |
| N07 | C05 | C06 | C04 | 179.8° | 179.5° |
| N07 | C05 | C06 | N01 | 180.0° | 179.7° |
| N07 | C05 | C04 | N11 | 0.1° | 0.0° |
| N07 | C05 | C04 | N03 | 179.9° | 180.0° |
| O33 | C06 | C05 | N01 | 178.8° | 179.2° |
| O33 | C06 | C05 | C04 | 179.0° | 180.0° |
| O33 | C06 | N01 | C02 | 178.7° | 179.7° |
| O33 | C06 | N01 | H5 | 1.2° | 0.2° |
| C05 | C06 | N01 | C02 | 0.1° | 0.5° |
| C06 | C05 | C04 | N11 | 179.7° | 179.5° |
| C06 | C05 | C04 | N03 | 0.3° | 0.5° |
| C06 | C05 | N07 | H10 | 114.7° | 119.6° |
| C05 | C06 | N01 | H5 | 179.9° | 179.5° |
| N01 | C06 | C05 | C04 | 0.2° | 0.8° |
| C06 | N01 | C02 | H5 | 180.0° | 180.0° |
| C06 | N01 | C02 | N03 | 0.2° | 0.0° |
| C06 | N01 | C02 | N34 | 179.5° | 179.8° |
| C05 | C04 | N11 | N03 | 180.0° | 180.0° |
| C05 | C04 | N03 | C02 | 0.2° | 0.0° |
| C04 | C05 | N07 | H10 | 65.2° | 59.9° |
| C05 | C04 | N11 | H12 | 180.0° | 180.0° |
| C05 | C04 | N11 | H13 | 60.0° | 0.1° |
| N01 | C02 | N03 | C04 | 0.1° | 0.3° |
| N01 | C02 | N03 | N34 | 179.3° | 179.7° |
| N01 | C02 | N34 | H16 | 179.3° | 179.7° |
| N01 | C02 | N34 | H17 | 0.7° | 0.3° |
| N11 | C04 | N03 | C02 | 179.8° | 180.0° |
| C04 | N11 | H12 | H13 | 120.0° | 179.9° |
| C04 | N03 | C02 | N34 | 179.3° | 180.0° |
| N03 | C04 | N11 | H12 | 0.0° | 0.0° |
| N03 | C04 | N11 | H13 | 120.0° | 179.9° |
| N03 | C02 | N34 | H16 | 0.0° | 0.0° |
| N03 | C02 | N34 | H17 | 180.0° | 180.0° |
| N03 | C02 | N01 | H5 | 179.8° | 180.0° |
| C02 | N34 | H16 | H17 | 180.0° | 180.0° |
| N34 | C02 | N01 | H5 | 0.5° | 0.3° |
| H1 | C13 | C14 | H6 | 1.4° | 0.3° |
| H2 | C21 | C23 | H8 | 83.5° | 175.1° |
| H2 | C21 | C23 | H9 | 36.5° | 65.0° |
| H2 | C21 | N20 | H14 | 156.4° | 145.0° |
| H3 | C26 | C23 | H8 | 162.3° | 180.0° |
| H3 | C26 | C23 | H9 | 42.4° | 60.0° |
| H4 | C26 | C23 | H8 | 78.5° | 60.0° |
| H4 | C26 | C23 | H9 | 161.6° | 180.0° |






