5SK
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| NAI | NAJ | sing | 1.29Å | 1.21Å | Aromatic |
| NAI | CAM | doub | 1.31Å | 1.33Å | Aromatic |
| NAJ | CAQ | doub | 1.32Å | 1.34Å | Aromatic |
| CAA | CAH | sing | 1.53Å | 1.53Å | |
| CAR | CAH | sing | 1.53Å | 1.53Å | |
| CAR | NAL | sing | 1.47Å | 1.50Å | |
| CAR | CAC | sing | 1.53Å | 1.54Å | |
| CAM | CAB | sing | 1.51Å | 1.53Å | |
| CAM | NAS | sing | 1.35Å | 1.34Å | Aromatic |
| NAL | CAN | sing | 1.38Å | 1.35Å | |
| CAQ | CAN | sing | 1.46Å | 1.34Å | Aromatic |
| CAQ | NAS | sing | 1.37Å | 1.33Å | Aromatic |
| CAN | NAK | doub | 1.31Å | 1.34Å | Aromatic |
| NAS | CAP | sing | 1.39Å | 1.35Å | Aromatic |
| NAK | CAO | sing | 1.36Å | 1.34Å | Aromatic |
| CAP | CAO | doub | 1.41Å | 1.39Å | Aromatic |
| CAP | CAG | sing | 1.39Å | 1.40Å | Aromatic |
| CAO | CAF | sing | 1.40Å | 1.39Å | Aromatic |
| CAG | CAE | doub | 1.38Å | 1.39Å | Aromatic |
| CAF | CAD | doub | 1.38Å | 1.39Å | Aromatic |
| CAE | CAD | sing | 1.39Å | 1.39Å | Aromatic |
| CAA | H1 | sing | 1.09Å | 1.10Å | |
| CAA | H2 | sing | 1.09Å | 1.10Å | |
| CAA | H3 | sing | 1.09Å | 1.10Å | |
| CAH | H4 | sing | 1.09Å | 1.10Å | |
| CAH | H5 | sing | 1.09Å | 1.10Å | |
| CAR | H6 | sing | 1.09Å | 1.10Å | |
| CAC | H7 | sing | 1.09Å | 1.10Å | |
| CAC | H8 | sing | 1.09Å | 1.10Å | |
| CAC | H9 | sing | 1.09Å | 1.10Å | |
| NAL | H10 | sing | 0.97Å | 1.00Å | |
| CAF | H11 | sing | 1.08Å | 1.08Å | |
| CAD | H12 | sing | 1.08Å | 1.08Å | |
| CAE | H13 | sing | 1.08Å | 1.08Å | |
| CAG | H14 | sing | 1.08Å | 1.08Å | |
| CAB | H15 | sing | 1.09Å | 1.10Å | |
| CAB | H16 | sing | 1.09Å | 1.10Å | |
| CAB | H17 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| NAJ | NAI | CAM | 108.4° | 110.1° |
| NAI | NAJ | CAQ | 110.7° | 109.4° |
| NAI | CAM | CAB | 121.4° | 126.2° |
| NAI | CAM | NAS | 109.2° | 107.5° |
| NAJ | CAQ | CAN | 132.0° | 134.1° |
| NAJ | CAQ | NAS | 108.0° | 106.9° |
| CAA | CAH | CAR | 110.6° | 109.5° |
| CAH | CAA | H1 | 109.5° | 109.5° |
| CAH | CAA | H2 | 109.5° | 109.4° |
| CAH | CAA | H3 | 109.5° | 109.5° |
| CAA | CAH | H4 | 109.2° | 109.5° |
| CAA | CAH | H5 | 109.2° | 109.5° |
| CAH | CAR | NAL | 108.8° | 109.5° |
| CAH | CAR | CAC | 107.5° | 109.5° |
| CAR | CAH | H4 | 109.2° | 109.5° |
| CAR | CAH | H5 | 109.2° | 109.4° |
| CAH | CAR | H6 | 107.9° | 109.5° |
| NAL | CAR | CAC | 116.3° | 109.5° |
| CAR | NAL | CAN | 128.8° | 120.0° |
| NAL | CAR | H6 | 108.2° | 109.5° |
| CAR | NAL | H10 | 104.4° | 120.0° |
| CAC | CAR | H6 | 107.8° | 109.5° |
| CAR | CAC | H7 | 109.5° | 109.4° |
| CAR | CAC | H8 | 109.4° | 109.5° |
| CAR | CAC | H9 | 109.5° | 109.4° |
| CAB | CAM | NAS | 129.3° | 126.3° |
| CAM | CAB | H15 | 109.5° | 109.5° |
| CAM | CAB | H16 | 109.4° | 109.5° |
| CAM | CAB | H17 | 109.5° | 109.5° |
| CAM | NAS | CAQ | 103.7° | 106.2° |
| CAM | NAS | CAP | 134.3° | 134.6° |
| NAL | CAN | CAQ | 115.8° | 120.1° |
| NAL | CAN | NAK | 124.3° | 120.0° |
| CAN | NAL | H10 | 104.4° | 120.0° |
| CAN | CAQ | NAS | 120.0° | 119.1° |
| CAQ | CAN | NAK | 119.9° | 119.9° |
| CAQ | NAS | CAP | 122.1° | 119.2° |
| CAN | NAK | CAO | 121.0° | 121.3° |
| NAS | CAP | CAO | 117.4° | 119.7° |
| NAS | CAP | CAG | 124.5° | 120.5° |
| NAK | CAO | CAP | 119.6° | 120.8° |
| NAK | CAO | CAF | 119.1° | 119.8° |
| CAO | CAP | CAG | 118.1° | 119.7° |
| CAP | CAO | CAF | 121.3° | 119.4° |
| CAP | CAG | CAE | 121.0° | 120.1° |
| CAP | CAG | H14 | 119.5° | 119.9° |
| CAO | CAF | CAD | 119.9° | 120.0° |
| CAO | CAF | H11 | 120.0° | 120.1° |
| CAG | CAE | CAD | 120.3° | 120.4° |
| CAG | CAE | H13 | 119.9° | 119.8° |
| CAE | CAG | H14 | 119.5° | 120.0° |
| CAF | CAD | CAE | 119.4° | 120.4° |
| CAD | CAF | H11 | 120.0° | 120.0° |
| CAF | CAD | H12 | 120.3° | 119.8° |
| CAE | CAD | H12 | 120.3° | 119.8° |
| CAD | CAE | H13 | 119.8° | 119.7° |
| H1 | CAA | H2 | 109.5° | 109.5° |
| H1 | CAA | H3 | 109.4° | 109.5° |
| H2 | CAA | H3 | 109.4° | 109.4° |
| H4 | CAH | H5 | 109.5° | 109.5° |
| H7 | CAC | H8 | 109.5° | 109.5° |
| H7 | CAC | H9 | 109.5° | 109.5° |
| H8 | CAC | H9 | 109.5° | 109.5° |
| H15 | CAB | H16 | 109.5° | 109.4° |
| H15 | CAB | H17 | 109.4° | 109.4° |
| H16 | CAB | H17 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| NAJ | NAI | CAM | CAB | 179.9° | 180.0° |
| NAJ | NAI | CAM | NAS | 0.3° | 0.6° |
| NAI | NAJ | CAQ | CAN | 179.6° | 180.0° |
| NAI | NAJ | CAQ | NAS | 0.4° | 0.3° |
| CAM | NAI | NAJ | CAQ | 0.4° | 0.6° |
| NAI | CAM | CAB | NAS | 179.8° | 179.3° |
| NAI | CAM | NAS | CAQ | 0.1° | 0.4° |
| NAI | CAM | NAS | CAP | 179.6° | 179.3° |
| NAI | CAM | CAB | H15 | 0.0° | 96.7° |
| NAI | CAM | CAB | H16 | 120.0° | 143.4° |
| NAI | CAM | CAB | H17 | 120.0° | 23.3° |
| NAJ | CAQ | NAS | CAM | 0.2° | 0.1° |
| NAJ | CAQ | CAN | NAL | 1.1° | 0.1° |
| NAJ | CAQ | CAN | NAS | 179.1° | 179.7° |
| NAJ | CAQ | CAN | NAK | 179.4° | 179.8° |
| NAJ | CAQ | NAS | CAP | 179.9° | 179.7° |
| CAA | CAH | CAR | H4 | 120.2° | 120.0° |
| CAA | CAH | CAR | H5 | 120.2° | 120.0° |
| CAA | CAH | CAR | NAL | 177.7° | 65.0° |
| CAA | CAH | CAR | CAC | 55.6° | 175.0° |
| CAH | CAA | H1 | H2 | 120.0° | 120.0° |
| CAH | CAA | H1 | H3 | 120.0° | 120.0° |
| CAH | CAA | H2 | H3 | 120.0° | 119.9° |
| CAA | CAH | H4 | H5 | 119.5° | 120.0° |
| CAA | CAH | CAR | H6 | 60.5° | 55.0° |
| CAH | CAR | NAL | CAC | 121.5° | 120.0° |
| CAH | CAR | NAL | H6 | 117.0° | 120.0° |
| CAH | CAR | CAC | H6 | 116.1° | 120.0° |
| CAH | CAR | NAL | CAN | 134.2° | 155.0° |
| CAR | CAH | CAA | H1 | 180.0° | 60.0° |
| CAR | CAH | CAA | H2 | 60.0° | 60.0° |
| CAR | CAH | CAA | H3 | 60.0° | 179.9° |
| CAR | CAH | H4 | H5 | 119.5° | 120.0° |
| CAH | CAR | CAC | H7 | 180.0° | 60.0° |
| CAH | CAR | CAC | H8 | 60.0° | 180.0° |
| CAH | CAR | CAC | H9 | 60.0° | 60.0° |
| CAH | CAR | NAL | H10 | 11.7° | 25.0° |
| NAL | CAR | CAC | H6 | 121.7° | 120.0° |
| CAR | NAL | CAN | H10 | 122.5° | 180.0° |
| CAR | NAL | CAN | CAQ | 145.6° | 179.7° |
| CAR | NAL | CAN | NAK | 36.1° | 0.0° |
| NAL | CAR | CAH | H4 | 62.1° | 175.0° |
| NAL | CAR | CAH | H5 | 57.5° | 55.0° |
| NAL | CAR | CAC | H7 | 57.8° | 60.0° |
| NAL | CAR | CAC | H8 | 177.8° | 60.0° |
| NAL | CAR | CAC | H9 | 62.3° | 180.0° |
| CAC | CAR | NAL | CAN | 12.7° | 85.0° |
| CAC | CAR | CAH | H4 | 64.6° | 55.0° |
| CAC | CAR | CAH | H5 | 175.7° | 65.0° |
| CAR | CAC | H7 | H8 | 120.0° | 120.0° |
| CAR | CAC | H7 | H9 | 120.0° | 120.0° |
| CAR | CAC | H8 | H9 | 120.0° | 120.0° |
| CAC | CAR | NAL | H10 | 109.8° | 95.0° |
| CAB | CAM | NAS | CAQ | 179.9° | 179.8° |
| CAB | CAM | NAS | CAP | 0.3° | 0.1° |
| CAM | CAB | H15 | H16 | 120.0° | 120.0° |
| CAM | CAB | H15 | H17 | 120.0° | 120.0° |
| CAM | CAB | H16 | H17 | 120.0° | 120.1° |
| CAM | NAS | CAQ | CAN | 179.5° | 179.7° |
| CAM | NAS | CAQ | CAP | 179.7° | 179.7° |
| CAM | NAS | CAP | CAO | 179.9° | 179.9° |
| CAM | NAS | CAP | CAG | 0.3° | 0.1° |
| NAS | CAM | CAB | H15 | 179.8° | 84.0° |
| NAS | CAM | CAB | H16 | 60.2° | 35.9° |
| NAS | CAM | CAB | H17 | 59.8° | 156.0° |
| NAL | CAN | CAQ | NAK | 178.4° | 179.7° |
| NAL | CAN | CAQ | NAS | 179.8° | 179.7° |
| NAL | CAN | NAK | CAO | 179.8° | 179.9° |
| CAN | NAL | CAR | H6 | 108.8° | 35.0° |
| CAN | CAQ | NAS | CAP | 0.8° | 0.6° |
| CAQ | CAN | NAK | CAO | 1.6° | 0.2° |
| CAQ | CAN | NAL | H10 | 91.9° | 0.3° |
| NAS | CAQ | CAN | NAK | 1.4° | 0.6° |
| CAQ | NAS | CAP | CAO | 0.3° | 0.3° |
| CAQ | NAS | CAP | CAG | 179.9° | 179.7° |
| CAN | NAK | CAO | CAP | 1.1° | 0.1° |
| CAN | NAK | CAO | CAF | 179.2° | 180.0° |
| NAK | CAN | NAL | H10 | 86.4° | 180.0° |
| NAS | CAP | CAO | NAK | 0.4° | 0.1° |
| NAS | CAP | CAO | CAG | 179.8° | 180.0° |
| NAS | CAP | CAO | CAF | 179.9° | 180.0° |
| NAS | CAP | CAG | CAE | 179.9° | 180.0° |
| NAS | CAP | CAG | H14 | 0.1° | 0.0° |
| NAK | CAO | CAP | CAF | 179.7° | 179.9° |
| NAK | CAO | CAP | CAG | 179.7° | 179.9° |
| NAK | CAO | CAF | CAD | 179.7° | 180.0° |
| NAK | CAO | CAF | H11 | 0.3° | 0.0° |
| CAO | CAP | CAG | CAE | 0.1° | 0.0° |
| CAP | CAO | CAF | CAD | 0.0° | 0.0° |
| CAP | CAO | CAF | H11 | 180.0° | 180.0° |
| CAO | CAP | CAG | H14 | 179.9° | 180.0° |
| CAG | CAP | CAO | CAF | 0.0° | 0.0° |
| CAP | CAG | CAE | H14 | 180.0° | 179.9° |
| CAP | CAG | CAE | CAD | 0.2° | 0.1° |
| CAP | CAG | CAE | H13 | 179.8° | 179.9° |
| CAO | CAF | CAD | H11 | 180.0° | 180.0° |
| CAO | CAF | CAD | CAE | 0.1° | 0.1° |
| CAO | CAF | CAD | H12 | 179.9° | 180.0° |
| CAG | CAE | CAD | CAF | 0.2° | 0.1° |
| CAG | CAE | CAD | H13 | 180.0° | 180.0° |
| CAG | CAE | CAD | H12 | 179.9° | 180.0° |
| CAF | CAD | CAE | H12 | 180.0° | 179.9° |
| CAF | CAD | CAE | H13 | 179.9° | 179.9° |
| CAE | CAD | CAF | H11 | 179.9° | 179.9° |
| CAD | CAE | CAG | H14 | 179.9° | 180.0° |
| H1 | CAA | H2 | H3 | 120.0° | 120.1° |
| H1 | CAA | CAH | H4 | 59.8° | 60.0° |
| H1 | CAA | CAH | H5 | 59.8° | 179.9° |
| H2 | CAA | CAH | H4 | 60.2° | 180.0° |
| H2 | CAA | CAH | H5 | 179.8° | 60.0° |
| H3 | CAA | CAH | H4 | 179.8° | 60.1° |
| H3 | CAA | CAH | H5 | 60.2° | 60.0° |
| H4 | CAH | CAR | H6 | 179.3° | 65.0° |
| H5 | CAH | CAR | H6 | 59.7° | 175.0° |
| H6 | CAR | CAC | H7 | 63.9° | 180.0° |
| H6 | CAR | CAC | H8 | 56.1° | 60.0° |
| H6 | CAR | CAC | H9 | 176.1° | 60.0° |
| H6 | CAR | NAL | H10 | 128.7° | 145.0° |
| H7 | CAC | H8 | H9 | 120.0° | 120.1° |
| H11 | CAF | CAD | H12 | 0.0° | 0.0° |
| H12 | CAD | CAE | H13 | 0.1° | 0.0° |
| H13 | CAE | CAG | H14 | 0.1° | 0.0° |
| H15 | CAB | H16 | H17 | 119.9° | 119.9° |
