F4J
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N18 | C19 | doub | 1.30Å | 1.49Å | |
| N18 | C17 | sing | 1.35Å | 1.35Å | |
| C19 | C13 | sing | 1.48Å | 1.45Å | |
| C17 | O20 | doub | 1.22Å | 1.29Å | |
| C17 | C14 | sing | 1.48Å | 1.50Å | |
| C13 | C12 | doub | 1.38Å | 1.40Å | Aromatic |
| C13 | C14 | sing | 1.41Å | 1.47Å | Aromatic |
| C5 | N6 | doub | 1.32Å | 1.36Å | Aromatic |
| C5 | N4 | sing | 1.31Å | 1.35Å | Aromatic |
| C12 | C11 | sing | 1.40Å | 1.41Å | Aromatic |
| C14 | C15 | doub | 1.38Å | 1.40Å | Aromatic |
| N6 | C1 | sing | 1.33Å | 1.37Å | Aromatic |
| N4 | C3 | doub | 1.34Å | 1.36Å | Aromatic |
| C11 | N10 | sing | 1.39Å | 1.38Å | |
| C11 | C16 | doub | 1.39Å | 1.42Å | Aromatic |
| C15 | C16 | sing | 1.39Å | 1.41Å | Aromatic |
| C1 | N10 | sing | 1.39Å | 1.39Å | |
| C1 | C2 | doub | 1.40Å | 1.50Å | Aromatic |
| C3 | C2 | sing | 1.41Å | 1.49Å | Aromatic |
| C3 | N7 | sing | 1.35Å | 1.35Å | Aromatic |
| C2 | N9 | sing | 1.38Å | 1.34Å | Aromatic |
| N7 | C8 | doub | 1.30Å | 1.36Å | Aromatic |
| N9 | C8 | sing | 1.35Å | 1.37Å | Aromatic |
| C19 | H1 | sing | 1.08Å | 1.08Å | |
| C12 | H2 | sing | 1.08Å | 1.08Å | |
| C15 | H3 | sing | 1.08Å | 1.08Å | |
| C16 | H4 | sing | 1.08Å | 1.08Å | |
| N10 | H5 | sing | 0.97Å | 1.00Å | |
| C5 | H6 | sing | 1.08Å | 1.08Å | |
| N9 | H7 | sing | 0.97Å | 1.00Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C19 | N18 | C17 | 107.9° | 111.9° |
| N18 | C19 | C13 | 105.3° | 109.4° |
| N18 | C19 | H1 | 127.3° | 125.4° |
| N18 | C17 | O20 | 121.2° | 126.0° |
| N18 | C17 | C14 | 114.1° | 108.0° |
| C19 | C13 | C12 | 127.9° | 134.6° |
| C19 | C13 | C14 | 111.6° | 105.6° |
| C13 | C19 | H1 | 127.3° | 125.2° |
| O20 | C17 | C14 | 124.7° | 126.0° |
| C17 | C14 | C13 | 101.0° | 105.1° |
| C17 | C14 | C15 | 138.4° | 134.8° |
| C12 | C13 | C14 | 120.5° | 119.8° |
| C13 | C12 | C11 | 119.0° | 119.6° |
| C13 | C12 | H2 | 120.5° | 120.2° |
| C13 | C14 | C15 | 120.6° | 120.2° |
| N6 | C5 | N4 | 123.2° | 122.6° |
| C5 | N6 | C1 | 124.3° | 121.1° |
| N6 | C5 | H6 | 118.4° | 118.8° |
| C5 | N4 | C3 | 120.1° | 120.5° |
| N4 | C5 | H6 | 118.4° | 118.7° |
| C12 | C11 | N10 | 122.3° | 119.9° |
| C12 | C11 | C16 | 119.6° | 120.2° |
| C11 | C12 | H2 | 120.5° | 120.2° |
| C14 | C15 | C16 | 117.2° | 119.9° |
| C14 | C15 | H3 | 121.4° | 120.1° |
| N6 | C1 | N10 | 124.2° | 120.7° |
| N6 | C1 | C2 | 114.8° | 118.5° |
| N4 | C3 | C2 | 119.4° | 118.7° |
| N4 | C3 | N7 | 134.0° | 134.5° |
| N10 | C11 | C16 | 118.1° | 119.9° |
| C11 | N10 | C1 | 128.3° | 120.0° |
| C11 | N10 | H5 | 115.9° | 120.0° |
| C11 | C16 | C15 | 123.1° | 120.3° |
| C11 | C16 | H4 | 118.4° | 119.8° |
| C16 | C15 | H3 | 121.4° | 120.0° |
| C15 | C16 | H4 | 118.4° | 119.9° |
| N10 | C1 | C2 | 121.0° | 120.8° |
| C1 | N10 | H5 | 115.8° | 120.0° |
| C1 | C2 | C3 | 118.2° | 118.6° |
| C1 | C2 | N9 | 135.4° | 135.3° |
| C2 | C3 | N7 | 106.6° | 106.8° |
| C3 | C2 | N9 | 106.4° | 106.1° |
| C3 | N7 | C8 | 107.6° | 109.7° |
| C2 | N9 | C8 | 107.7° | 107.1° |
| C2 | N9 | H7 | 126.1° | 126.4° |
| N7 | C8 | N9 | 111.7° | 110.2° |
| N7 | C8 | H8 | 124.2° | 124.9° |
| C8 | N9 | H7 | 126.1° | 126.4° |
| N9 | C8 | H8 | 124.2° | 124.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N18 | C19 | C13 | H1 | 180.0° | 180.0° |
| C19 | N18 | C17 | O20 | 179.2° | 179.9° |
| C19 | N18 | C17 | C14 | 0.6° | 0.3° |
| N18 | C19 | C13 | C12 | 179.7° | 179.9° |
| N18 | C19 | C13 | C14 | 0.3° | 0.2° |
| C17 | N18 | C19 | C13 | 0.5° | 0.0° |
| N18 | C17 | O20 | C14 | 179.7° | 179.6° |
| N18 | C17 | C14 | C13 | 0.3° | 0.4° |
| N18 | C17 | C14 | C15 | 179.6° | 179.8° |
| C17 | N18 | C19 | H1 | 179.5° | 180.0° |
| C19 | C13 | C14 | C17 | 0.0° | 0.4° |
| C19 | C13 | C12 | C14 | 180.0° | 179.7° |
| C19 | C13 | C12 | C11 | 179.8° | 180.0° |
| C19 | C13 | C14 | C15 | 180.0° | 179.8° |
| C19 | C13 | C12 | H2 | 0.2° | 0.1° |
| O20 | C17 | C14 | C13 | 179.4° | 179.9° |
| O20 | C17 | C14 | C15 | 0.7° | 0.1° |
| C17 | C14 | C13 | C12 | 180.0° | 179.9° |
| C17 | C14 | C13 | C15 | 180.0° | 179.9° |
| C17 | C14 | C15 | C16 | 179.8° | 180.0° |
| C17 | C14 | C15 | H3 | 0.2° | 0.1° |
| C13 | C12 | C11 | H2 | 180.0° | 179.9° |
| C12 | C13 | C14 | C15 | 0.0° | 0.0° |
| C13 | C12 | C11 | N10 | 179.7° | 180.0° |
| C13 | C12 | C11 | C16 | 0.2° | 0.7° |
| C12 | C13 | C19 | H1 | 0.3° | 0.0° |
| C14 | C13 | C12 | C11 | 0.2° | 0.3° |
| C13 | C14 | C15 | C16 | 0.3° | 0.2° |
| C14 | C13 | C19 | H1 | 179.7° | 179.8° |
| C14 | C13 | C12 | H2 | 179.8° | 179.8° |
| C13 | C14 | C15 | H3 | 179.7° | 179.9° |
| N6 | C5 | N4 | H6 | 180.0° | 179.9° |
| N6 | C5 | N4 | C3 | 0.5° | 0.1° |
| C5 | N6 | C1 | N10 | 179.6° | 180.0° |
| C5 | N6 | C1 | C2 | 0.3° | 0.2° |
| N4 | C5 | N6 | C1 | 0.4° | 0.1° |
| C5 | N4 | C3 | C2 | 0.5° | 0.2° |
| C5 | N4 | C3 | N7 | 179.8° | 179.3° |
| C12 | C11 | N10 | C16 | 179.9° | 179.3° |
| C12 | C11 | C16 | C15 | 0.1° | 0.9° |
| C12 | C11 | N10 | C1 | 5.3° | 36.3° |
| C12 | C11 | C16 | H4 | 179.8° | 179.7° |
| C12 | C11 | N10 | H5 | 174.7° | 143.8° |
| C14 | C15 | C16 | C11 | 0.4° | 0.6° |
| C14 | C15 | C16 | H3 | 180.0° | 180.0° |
| C14 | C15 | C16 | H4 | 179.6° | 180.0° |
| N6 | C1 | N10 | C11 | 12.7° | 5.5° |
| N6 | C1 | N10 | C2 | 179.8° | 179.8° |
| N6 | C1 | C2 | C3 | 0.3° | 0.5° |
| N6 | C1 | C2 | N9 | 179.6° | 179.9° |
| N6 | C1 | N10 | H5 | 167.3° | 174.5° |
| C1 | N6 | C5 | H6 | 179.6° | 180.0° |
| N4 | C3 | C2 | C1 | 0.4° | 0.5° |
| N4 | C3 | C2 | N7 | 179.7° | 179.3° |
| N4 | C3 | C2 | N9 | 179.5° | 179.7° |
| N4 | C3 | N7 | C8 | 179.4° | 179.5° |
| C3 | N4 | C5 | H6 | 179.5° | 180.0° |
| N10 | C11 | C16 | C15 | 180.0° | 179.8° |
| C11 | N10 | C1 | H5 | 180.0° | 179.9° |
| C11 | N10 | C1 | C2 | 167.5° | 174.3° |
| N10 | C11 | C12 | H2 | 0.3° | 0.0° |
| N10 | C11 | C16 | H4 | 0.1° | 0.4° |
| C11 | C16 | C15 | H4 | 180.0° | 179.4° |
| C16 | C11 | N10 | C1 | 174.6° | 144.4° |
| C16 | C11 | C12 | H2 | 179.8° | 179.3° |
| C11 | C16 | C15 | H3 | 179.7° | 179.4° |
| C16 | C11 | N10 | H5 | 5.4° | 35.5° |
| N10 | C1 | C2 | C3 | 179.6° | 179.7° |
| N10 | C1 | C2 | N9 | 0.6° | 0.1° |
| C1 | C2 | C3 | N9 | 179.9° | 179.7° |
| C1 | C2 | C3 | N7 | 179.8° | 179.8° |
| C1 | C2 | N9 | C8 | 180.0° | 180.0° |
| C2 | C1 | N10 | H5 | 12.5° | 5.8° |
| C1 | C2 | N9 | H7 | 0.0° | 0.1° |
| C2 | C3 | N7 | C8 | 0.3° | 0.4° |
| C3 | C2 | N9 | C8 | 0.1° | 0.3° |
| C3 | C2 | N9 | H7 | 179.9° | 179.8° |
| N7 | C3 | C2 | N9 | 0.3° | 0.4° |
| C3 | N7 | C8 | N9 | 0.3° | 0.2° |
| C3 | N7 | C8 | H8 | 179.7° | 179.7° |
| C2 | N9 | C8 | N7 | 0.1° | 0.1° |
| C2 | N9 | C8 | H7 | 180.0° | 179.9° |
| C2 | N9 | C8 | H8 | 179.9° | 180.0° |
| N7 | C8 | N9 | H8 | 180.0° | 179.9° |
| N7 | C8 | N9 | H7 | 179.9° | 180.0° |
| H3 | C15 | C16 | H4 | 0.4° | 0.1° |
| H7 | N9 | C8 | H8 | 0.1° | 0.1° |
