V87
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAE | CAC | doub | 1.21Å | 1.19Å | |
| CAG | CAH | sing | 1.53Å | 1.53Å | |
| CAG | CAF | sing | 1.53Å | 1.52Å | |
| CAC | NAD | sing | 1.35Å | 1.46Å | |
| CAI | CAH | sing | 1.53Å | 1.52Å | |
| CAI | CAJ | sing | 1.51Å | 1.52Å | |
| NAD | CAF | sing | 1.46Å | 1.46Å | |
| CAO | CAJ | doub | 1.38Å | 1.39Å | Aromatic |
| CAO | CAN | sing | 1.38Å | 1.39Å | Aromatic |
| CAJ | CAK | sing | 1.38Å | 1.38Å | Aromatic |
| CAN | CAM | doub | 1.38Å | 1.39Å | Aromatic |
| CAK | CAL | doub | 1.38Å | 1.39Å | Aromatic |
| CAM | CAL | sing | 1.38Å | 1.39Å | Aromatic |
| CAC | H1 | sing | 1.08Å | 1.08Å | |
| NAD | H2 | sing | 0.97Å | 1.00Å | |
| CAF | H3 | sing | 1.09Å | 1.10Å | |
| CAF | H4 | sing | 1.09Å | 1.10Å | |
| CAG | H5 | sing | 1.09Å | 1.10Å | |
| CAG | H6 | sing | 1.09Å | 1.10Å | |
| CAH | H7 | sing | 1.09Å | 1.10Å | |
| CAH | H8 | sing | 1.09Å | 1.10Å | |
| CAI | H9 | sing | 1.09Å | 1.10Å | |
| CAI | H10 | sing | 1.09Å | 1.10Å | |
| CAK | H11 | sing | 1.08Å | 1.08Å | |
| CAL | H12 | sing | 1.08Å | 1.08Å | |
| CAM | H13 | sing | 1.08Å | 1.08Å | |
| CAN | H14 | sing | 1.08Å | 1.08Å | |
| CAO | H15 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAE | CAC | NAD | 118.7° | 120.0° |
| OAE | CAC | H1 | 120.6° | 120.0° |
| CAH | CAG | CAF | 108.4° | 109.5° |
| CAG | CAH | CAI | 113.5° | 109.5° |
| CAH | CAG | H5 | 109.7° | 109.4° |
| CAH | CAG | H6 | 109.8° | 109.5° |
| CAG | CAH | H7 | 108.4° | 109.4° |
| CAG | CAH | H8 | 108.4° | 109.5° |
| CAG | CAF | NAD | 114.3° | 109.5° |
| CAG | CAF | H3 | 108.2° | 109.5° |
| CAG | CAF | H4 | 108.3° | 109.5° |
| CAF | CAG | H5 | 109.8° | 109.5° |
| CAF | CAG | H6 | 109.7° | 109.5° |
| CAC | NAD | CAF | 124.7° | 120.0° |
| NAD | CAC | H1 | 120.6° | 120.0° |
| CAC | NAD | H2 | 117.6° | 120.0° |
| CAH | CAI | CAJ | 108.2° | 109.4° |
| CAI | CAH | H7 | 108.5° | 109.5° |
| CAI | CAH | H8 | 108.5° | 109.5° |
| CAH | CAI | H9 | 109.8° | 109.4° |
| CAH | CAI | H10 | 109.8° | 109.5° |
| CAI | CAJ | CAO | 120.1° | 120.0° |
| CAI | CAJ | CAK | 119.7° | 120.0° |
| CAJ | CAI | H9 | 109.8° | 109.5° |
| CAJ | CAI | H10 | 109.8° | 109.5° |
| CAF | NAD | H2 | 117.7° | 120.0° |
| NAD | CAF | H3 | 108.3° | 109.5° |
| NAD | CAF | H4 | 108.3° | 109.5° |
| CAJ | CAO | CAN | 120.1° | 120.1° |
| CAO | CAJ | CAK | 120.2° | 120.0° |
| CAJ | CAO | H15 | 120.0° | 120.0° |
| CAO | CAN | CAM | 119.9° | 119.9° |
| CAO | CAN | H14 | 120.0° | 120.0° |
| CAN | CAO | H15 | 120.0° | 120.0° |
| CAJ | CAK | CAL | 119.7° | 120.0° |
| CAJ | CAK | H11 | 120.1° | 120.0° |
| CAN | CAM | CAL | 119.6° | 120.1° |
| CAN | CAM | H13 | 120.2° | 119.9° |
| CAM | CAN | H14 | 120.1° | 120.1° |
| CAK | CAL | CAM | 120.5° | 120.0° |
| CAL | CAK | H11 | 120.2° | 120.0° |
| CAK | CAL | H12 | 119.8° | 120.0° |
| CAM | CAL | H12 | 119.7° | 120.0° |
| CAL | CAM | H13 | 120.2° | 120.0° |
| H3 | CAF | H4 | 109.5° | 109.4° |
| H5 | CAG | H6 | 109.4° | 109.5° |
| H7 | CAH | H8 | 109.5° | 109.4° |
| H9 | CAI | H10 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAE | CAC | NAD | H1 | 180.0° | 179.6° |
| OAE | CAC | NAD | CAF | 0.6° | 0.3° |
| OAE | CAC | NAD | H2 | 179.4° | 179.7° |
| CAH | CAG | CAF | H5 | 119.8° | 120.0° |
| CAH | CAG | CAF | H6 | 119.9° | 120.0° |
| CAG | CAH | CAI | H7 | 120.6° | 120.0° |
| CAG | CAH | CAI | H8 | 120.6° | 120.0° |
| CAG | CAH | CAI | CAJ | 176.4° | 180.0° |
| CAH | CAG | CAF | NAD | 133.0° | 180.0° |
| CAH | CAG | CAF | H3 | 106.3° | 60.0° |
| CAH | CAG | CAF | H4 | 12.2° | 60.0° |
| CAH | CAG | H5 | H6 | 120.5° | 120.0° |
| CAG | CAH | H7 | H8 | 118.1° | 120.0° |
| CAG | CAH | CAI | H9 | 56.6° | 60.0° |
| CAG | CAH | CAI | H10 | 63.8° | 60.0° |
| CAG | CAF | NAD | CAC | 38.0° | 180.0° |
| CAF | CAG | CAH | CAI | 125.7° | NaN° |
| CAG | CAF | NAD | H3 | 120.7° | 120.0° |
| CAG | CAF | NAD | H4 | 120.7° | 120.0° |
| CAG | CAF | NAD | H2 | 142.1° | 0.0° |
| CAG | CAF | H3 | H4 | 117.8° | 120.0° |
| CAF | CAG | H5 | H6 | 120.5° | 120.0° |
| CAF | CAG | CAH | H7 | 5.1° | 60.0° |
| CAF | CAG | CAH | H8 | 113.7° | 60.0° |
| CAC | NAD | CAF | H2 | 180.0° | 180.0° |
| CAC | NAD | CAF | H3 | 158.7° | 60.0° |
| CAC | NAD | CAF | H4 | 82.8° | 59.9° |
| CAH | CAI | CAJ | H9 | 119.8° | 119.9° |
| CAH | CAI | CAJ | H10 | 119.8° | 120.0° |
| CAH | CAI | CAJ | CAO | 73.6° | 90.3° |
| CAH | CAI | CAJ | CAK | 106.3° | 90.0° |
| CAI | CAH | CAG | H5 | 5.8° | 60.0° |
| CAI | CAH | CAG | H6 | 114.4° | 60.0° |
| CAI | CAH | H7 | H8 | 118.2° | 120.0° |
| CAH | CAI | H9 | H10 | 120.6° | 120.0° |
| CAI | CAJ | CAO | CAK | 179.9° | 179.7° |
| CAI | CAJ | CAO | CAN | 180.0° | 179.7° |
| CAI | CAJ | CAK | CAL | 179.3° | 180.0° |
| CAJ | CAI | CAH | H7 | 63.0° | 60.0° |
| CAJ | CAI | CAH | H8 | 55.8° | 60.0° |
| CAJ | CAI | H9 | H10 | 120.6° | 120.1° |
| CAI | CAJ | CAK | H11 | 0.8° | 0.1° |
| CAI | CAJ | CAO | H15 | 0.0° | 0.0° |
| CAF | NAD | CAC | H1 | 179.4° | 179.9° |
| NAD | CAF | H3 | H4 | 117.8° | 120.0° |
| NAD | CAF | CAG | H5 | 13.1° | 60.0° |
| NAD | CAF | CAG | H6 | 107.2° | 60.0° |
| CAJ | CAO | CAN | H15 | 180.0° | 179.7° |
| CAJ | CAO | CAN | CAM | 0.4° | 0.6° |
| CAO | CAJ | CAK | CAL | 0.6° | 0.3° |
| CAO | CAJ | CAI | H9 | 46.2° | 149.8° |
| CAO | CAJ | CAI | H10 | 166.6° | 29.7° |
| CAO | CAJ | CAK | H11 | 179.4° | 179.7° |
| CAJ | CAO | CAN | H14 | 179.6° | 179.7° |
| CAN | CAO | CAJ | CAK | 0.1° | 0.6° |
| CAO | CAN | CAM | H14 | 180.0° | 179.7° |
| CAO | CAN | CAM | CAL | 0.1° | 0.3° |
| CAO | CAN | CAM | H13 | 179.9° | 179.7° |
| CAJ | CAK | CAL | H11 | 180.0° | 180.0° |
| CAJ | CAK | CAL | CAM | 1.1° | 0.0° |
| CAK | CAJ | CAI | H9 | 133.9° | 29.9° |
| CAK | CAJ | CAI | H10 | 13.5° | 150.0° |
| CAJ | CAK | CAL | H12 | 178.9° | 180.0° |
| CAK | CAJ | CAO | H15 | 179.9° | 179.7° |
| CAN | CAM | CAL | CAK | 0.8° | 0.0° |
| CAN | CAM | CAL | H13 | 180.0° | 179.9° |
| CAN | CAM | CAL | H12 | 179.2° | 180.0° |
| CAM | CAN | CAO | H15 | 179.6° | 179.7° |
| CAK | CAL | CAM | H12 | 180.0° | 180.0° |
| CAK | CAL | CAM | H13 | 179.1° | 179.9° |
| CAM | CAL | CAK | H11 | 178.9° | 180.0° |
| CAL | CAM | CAN | H14 | 179.9° | 180.0° |
| H1 | CAC | NAD | H2 | 0.5° | 0.1° |
| H2 | NAD | CAF | H3 | 21.4° | 120.0° |
| H2 | NAD | CAF | H4 | 97.2° | 120.0° |
| H3 | CAF | CAG | H5 | 133.8° | 179.9° |
| H3 | CAF | CAG | H6 | 13.5° | 60.0° |
| H4 | CAF | CAG | H5 | 107.6° | 60.0° |
| H4 | CAF | CAG | H6 | 132.1° | 180.0° |
| H5 | CAG | CAH | H7 | 114.8° | 180.0° |
| H5 | CAG | CAH | H8 | 126.5° | 60.1° |
| H6 | CAG | CAH | H7 | 124.9° | 60.0° |
| H6 | CAG | CAH | H8 | 6.2° | 180.0° |
| H7 | CAH | CAI | H9 | 177.2° | 180.0° |
| H7 | CAH | CAI | H10 | 56.8° | 60.0° |
| H8 | CAH | CAI | H9 | 64.0° | 60.0° |
| H8 | CAH | CAI | H10 | 175.6° | 180.0° |
| H11 | CAK | CAL | H12 | 1.1° | 0.0° |
| H12 | CAL | CAM | H13 | 0.9° | 0.0° |
| H13 | CAM | CAN | H14 | 0.2° | 0.0° |
| H14 | CAN | CAO | H15 | 0.4° | 0.0° |
