5QX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O | C | doub | 1.21Å | 1.23Å | |
| C | CA | sing | 1.51Å | 1.40Å | |
| C | NAL | sing | 1.35Å | 1.34Å | |
| CAA | NAL | sing | 1.47Å | 1.47Å | |
| CA | N | sing | 1.47Å | 1.48Å | |
| NAL | CAK | sing | 1.40Å | 1.34Å | |
| CAK | CAF | doub | 1.38Å | 1.39Å | Aromatic |
| CAK | CAJ | sing | 1.40Å | 1.39Å | Aromatic |
| N | CAJ | sing | 1.40Å | 1.39Å | |
| CAF | CAD | sing | 1.38Å | 1.39Å | Aromatic |
| CAJ | CAE | doub | 1.38Å | 1.39Å | Aromatic |
| CAD | CAC | doub | 1.38Å | 1.39Å | Aromatic |
| CAE | CAC | sing | 1.38Å | 1.39Å | Aromatic |
| CA | H1 | sing | 1.09Å | 1.10Å | |
| CA | H2 | sing | 1.09Å | 1.10Å | |
| N | H3 | sing | 0.97Å | 1.00Å | |
| CAE | H4 | sing | 1.08Å | 1.08Å | |
| CAC | H5 | sing | 1.08Å | 1.08Å | |
| CAD | H6 | sing | 1.08Å | 1.08Å | |
| CAF | H7 | sing | 1.08Å | 1.08Å | |
| CAA | H8 | sing | 1.09Å | 1.10Å | |
| CAA | H9 | sing | 1.09Å | 1.10Å | |
| CAA | H10 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C | CA | 120.0° | 119.6° |
| O | C | NAL | 118.0° | 119.6° |
| CA | C | NAL | 122.0° | 120.8° |
| C | CA | N | 113.8° | 109.0° |
| C | CA | H1 | 108.4° | 109.5° |
| C | CA | H2 | 108.4° | 109.5° |
| C | NAL | CAA | 118.7° | 119.7° |
| C | NAL | CAK | 122.2° | 120.7° |
| CAA | NAL | CAK | 119.0° | 119.6° |
| NAL | CAA | H8 | 109.5° | 109.5° |
| NAL | CAA | H9 | 109.4° | 109.4° |
| NAL | CAA | H10 | 109.5° | 109.5° |
| CA | N | CAJ | 119.1° | 117.9° |
| N | CA | H1 | 108.4° | 109.5° |
| N | CA | H2 | 108.4° | 109.6° |
| CA | N | H3 | 107.0° | 121.0° |
| NAL | CAK | CAF | 119.9° | 120.8° |
| NAL | CAK | CAJ | 120.4° | 119.5° |
| CAF | CAK | CAJ | 119.7° | 119.7° |
| CAK | CAF | CAD | 119.9° | 119.9° |
| CAK | CAF | H7 | 120.0° | 120.1° |
| CAK | CAJ | N | 119.1° | 118.7° |
| CAK | CAJ | CAE | 120.8° | 120.2° |
| N | CAJ | CAE | 120.1° | 121.1° |
| CAJ | N | H3 | 107.0° | 121.0° |
| CAF | CAD | CAC | 120.3° | 120.4° |
| CAF | CAD | H6 | 119.8° | 119.9° |
| CAD | CAF | H7 | 120.1° | 120.0° |
| CAJ | CAE | CAC | 119.4° | 119.7° |
| CAJ | CAE | H4 | 120.3° | 120.1° |
| CAD | CAC | CAE | 119.9° | 120.2° |
| CAD | CAC | H5 | 120.0° | 120.0° |
| CAC | CAD | H6 | 119.8° | 119.7° |
| CAC | CAE | H4 | 120.3° | 120.2° |
| CAE | CAC | H5 | 120.0° | 119.9° |
| H1 | CA | H2 | 109.4° | 109.6° |
| H8 | CAA | H9 | 109.5° | 109.5° |
| H8 | CAA | H10 | 109.4° | 109.5° |
| H9 | CAA | H10 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | CA | NAL | 177.7° | 179.7° |
| O | C | NAL | CAA | 1.6° | 2.4° |
| O | C | CA | N | 165.4° | 150.9° |
| O | C | NAL | CAK | 178.7° | 177.9° |
| O | C | CA | H1 | 44.7° | 89.2° |
| O | C | CA | H2 | 74.0° | 31.0° |
| CA | C | NAL | CAA | 179.3° | 177.9° |
| C | CA | N | H1 | 120.7° | 119.9° |
| C | CA | N | H2 | 120.7° | 119.9° |
| CA | C | NAL | CAK | 3.6° | 1.8° |
| C | CA | N | CAJ | 21.6° | 42.0° |
| C | CA | H1 | H2 | 118.0° | 120.2° |
| C | CA | N | H3 | 99.9° | 138.1° |
| C | NAL | CAA | CAK | 177.2° | 179.7° |
| NAL | C | CA | N | 16.9° | 28.8° |
| C | NAL | CAK | CAF | 175.1° | 165.8° |
| C | NAL | CAK | CAJ | 6.4° | 14.8° |
| NAL | C | CA | H1 | 137.6° | 91.1° |
| NAL | C | CA | H2 | 103.7° | 148.6° |
| C | NAL | CAA | H8 | 180.0° | 0.0° |
| C | NAL | CAA | H9 | 60.0° | 120.0° |
| C | NAL | CAA | H10 | 60.0° | 120.0° |
| CAA | NAL | CAK | CAF | 7.8° | 13.9° |
| CAA | NAL | CAK | CAJ | 170.7° | 165.5° |
| NAL | CAA | H8 | H9 | 120.0° | 120.0° |
| NAL | CAA | H8 | H10 | 120.0° | 120.0° |
| NAL | CAA | H9 | H10 | 120.0° | 120.0° |
| CA | N | CAJ | CAK | 13.2° | 29.3° |
| CA | N | CAJ | H3 | 121.4° | 179.9° |
| CA | N | CAJ | CAE | 166.8° | 150.7° |
| N | CA | H1 | H2 | 118.0° | 120.3° |
| NAL | CAK | CAF | CAJ | 178.5° | 179.4° |
| NAL | CAK | CAJ | N | 1.1° | 0.9° |
| NAL | CAK | CAF | CAD | 179.2° | 179.2° |
| NAL | CAK | CAJ | CAE | 178.9° | 179.2° |
| NAL | CAK | CAF | H7 | 0.8° | 0.8° |
| CAK | NAL | CAA | H8 | 2.8° | 179.7° |
| CAK | NAL | CAA | H9 | 122.8° | 59.7° |
| CAK | NAL | CAA | H10 | 117.2° | 60.3° |
| CAF | CAK | CAJ | N | 179.5° | 179.7° |
| CAK | CAF | CAD | H7 | 180.0° | 179.9° |
| CAF | CAK | CAJ | CAE | 0.5° | 0.3° |
| CAK | CAF | CAD | CAC | 0.5° | 0.1° |
| CAK | CAF | CAD | H6 | 179.5° | 179.9° |
| CAK | CAJ | N | CAE | 180.0° | 180.0° |
| CAJ | CAK | CAF | CAD | 0.7° | 0.2° |
| CAK | CAJ | CAE | CAC | 0.0° | 0.1° |
| CAK | CAJ | N | H3 | 108.2° | 150.8° |
| CAK | CAJ | CAE | H4 | 180.0° | 179.8° |
| CAJ | CAK | CAF | H7 | 179.3° | 179.8° |
| N | CAJ | CAE | CAC | 180.0° | 179.8° |
| CAJ | N | CA | H1 | 142.2° | 77.8° |
| CAJ | N | CA | H2 | 99.1° | 161.9° |
| N | CAJ | CAE | H4 | 0.0° | 0.2° |
| CAF | CAD | CAC | H6 | 180.0° | 180.0° |
| CAF | CAD | CAC | CAE | 0.0° | 0.1° |
| CAF | CAD | CAC | H5 | 180.0° | 179.9° |
| CAJ | CAE | CAC | CAD | 0.3° | 0.1° |
| CAJ | CAE | CAC | H4 | 180.0° | 180.0° |
| CAE | CAJ | N | H3 | 71.8° | 29.2° |
| CAJ | CAE | CAC | H5 | 179.7° | 180.0° |
| CAD | CAC | CAE | H5 | 180.0° | 179.9° |
| CAD | CAC | CAE | H4 | 179.7° | 180.0° |
| CAC | CAD | CAF | H7 | 179.5° | 180.0° |
| CAE | CAC | CAD | H6 | 180.0° | 179.9° |
| H1 | CA | N | H3 | 20.8° | 102.1° |
| H2 | CA | N | H3 | 139.5° | 18.2° |
| H4 | CAE | CAC | H5 | 0.3° | 0.0° |
| H5 | CAC | CAD | H6 | 0.0° | 0.0° |
| H6 | CAD | CAF | H7 | 0.5° | 0.0° |
| H8 | CAA | H9 | H10 | 120.0° | 120.0° |
