0RY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| NAA | CAN | sing | 1.35Å | 1.33Å | |
| OAC | CAN | doub | 1.22Å | 1.23Å | |
| CAN | CAQ | sing | 1.48Å | 1.57Å | |
| CAQ | CAK | doub | 1.39Å | 1.40Å | Aromatic |
| CAQ | CAJ | sing | 1.40Å | 1.38Å | Aromatic |
| OAD | CAO | doub | 1.22Å | 1.23Å | |
| CAK | CAP | sing | 1.39Å | 1.40Å | Aromatic |
| CAJ | CAH | doub | 1.38Å | 1.40Å | Aromatic |
| CAO | NAL | sing | 1.35Å | 1.34Å | |
| CAO | CAG | sing | 1.48Å | 1.42Å | |
| CAP | NAL | sing | 1.40Å | 1.34Å | |
| CAP | CAI | doub | 1.39Å | 1.40Å | Aromatic |
| CAG | CAF | doub | 1.34Å | 1.41Å | |
| CAH | CAI | sing | 1.38Å | 1.38Å | Aromatic |
| CAF | CAM | sing | 1.48Å | 1.42Å | |
| OAB | CAM | doub | 1.21Å | 1.26Å | |
| CAM | OAE | sing | 1.35Å | 1.25Å | |
| OAE | H1 | sing | 0.97Å | 0.95Å | |
| CAF | H2 | sing | 1.08Å | 1.08Å | |
| CAG | H3 | sing | 1.08Å | 1.08Å | |
| NAL | H4 | sing | 0.97Å | 1.00Å | |
| CAK | H5 | sing | 1.08Å | 1.08Å | |
| CAI | H6 | sing | 1.08Å | 1.08Å | |
| CAH | H7 | sing | 1.08Å | 1.08Å | |
| CAJ | H8 | sing | 1.08Å | 1.08Å | |
| NAA | H9 | sing | 0.97Å | 1.00Å | |
| NAA | H10 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| NAA | CAN | OAC | 122.0° | 120.0° |
| NAA | CAN | CAQ | 118.0° | 120.0° |
| CAN | NAA | H9 | 120.0° | 120.0° |
| CAN | NAA | H10 | 120.0° | 120.0° |
| OAC | CAN | CAQ | 119.4° | 120.0° |
| CAN | CAQ | CAK | 123.9° | 120.1° |
| CAN | CAQ | CAJ | 118.2° | 120.1° |
| CAK | CAQ | CAJ | 117.9° | 119.8° |
| CAQ | CAK | CAP | 121.9° | 119.7° |
| CAQ | CAK | H5 | 119.0° | 120.1° |
| CAQ | CAJ | CAH | 120.6° | 120.0° |
| CAQ | CAJ | H8 | 119.7° | 120.0° |
| OAD | CAO | NAL | 123.8° | 120.0° |
| OAD | CAO | CAG | 115.3° | 120.0° |
| CAK | CAP | NAL | 128.7° | 120.0° |
| CAK | CAP | CAI | 118.8° | 120.0° |
| CAP | CAK | H5 | 119.0° | 120.1° |
| CAJ | CAH | CAI | 121.3° | 120.2° |
| CAJ | CAH | H7 | 119.4° | 119.9° |
| CAH | CAJ | H8 | 119.7° | 120.0° |
| NAL | CAO | CAG | 120.9° | 120.0° |
| CAO | NAL | CAP | 126.9° | 120.0° |
| CAO | NAL | H4 | 116.5° | 120.0° |
| CAO | CAG | CAF | 131.7° | 120.0° |
| CAO | CAG | H3 | 114.1° | 120.0° |
| NAL | CAP | CAI | 112.5° | 120.0° |
| CAP | NAL | H4 | 116.6° | 120.0° |
| CAP | CAI | CAH | 119.5° | 120.2° |
| CAP | CAI | H6 | 120.2° | 119.9° |
| CAG | CAF | CAM | 132.3° | 120.0° |
| CAG | CAF | H2 | 113.8° | 120.0° |
| CAF | CAG | H3 | 114.2° | 120.0° |
| CAH | CAI | H6 | 120.3° | 119.9° |
| CAI | CAH | H7 | 119.4° | 119.9° |
| CAF | CAM | OAB | 121.9° | 120.0° |
| CAF | CAM | OAE | 115.6° | 120.0° |
| CAM | CAF | H2 | 113.8° | 119.9° |
| OAB | CAM | OAE | 122.1° | 120.0° |
| CAM | OAE | H1 | 109.5° | 117.0° |
| H9 | NAA | H10 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| NAA | CAN | OAC | CAQ | 171.3° | 179.9° |
| NAA | CAN | CAQ | CAK | 32.7° | 180.0° |
| NAA | CAN | CAQ | CAJ | 146.5° | 0.1° |
| CAN | NAA | H9 | H10 | 180.0° | 180.0° |
| OAC | CAN | CAQ | CAK | 139.0° | 0.1° |
| OAC | CAN | CAQ | CAJ | 41.8° | 180.0° |
| OAC | CAN | NAA | H9 | 0.0° | 180.0° |
| OAC | CAN | NAA | H10 | 180.0° | 0.1° |
| CAN | CAQ | CAK | CAJ | 179.2° | 180.0° |
| CAN | CAQ | CAK | CAP | 179.9° | 180.0° |
| CAN | CAQ | CAJ | CAH | 179.8° | 179.8° |
| CAN | CAQ | CAK | H5 | 0.1° | 0.0° |
| CAN | CAQ | CAJ | H8 | 0.2° | 0.1° |
| CAQ | CAN | NAA | H9 | 171.4° | 0.0° |
| CAQ | CAN | NAA | H10 | 8.6° | 180.0° |
| CAQ | CAK | CAP | H5 | 180.0° | 180.0° |
| CAK | CAQ | CAJ | CAH | 0.6° | 0.3° |
| CAQ | CAK | CAP | NAL | 176.7° | 180.0° |
| CAQ | CAK | CAP | CAI | 0.2° | 0.3° |
| CAK | CAQ | CAJ | H8 | 179.5° | 180.0° |
| CAJ | CAQ | CAK | CAP | 0.9° | 0.0° |
| CAQ | CAJ | CAH | H8 | 180.0° | 179.7° |
| CAQ | CAJ | CAH | CAI | 0.5° | 0.3° |
| CAJ | CAQ | CAK | H5 | 179.1° | 180.0° |
| CAQ | CAJ | CAH | H7 | 179.5° | 179.7° |
| OAD | CAO | NAL | CAG | 177.7° | 180.0° |
| OAD | CAO | NAL | CAP | 13.7° | 5.0° |
| OAD | CAO | CAG | CAF | 172.7° | 16.1° |
| OAD | CAO | CAG | H3 | 7.4° | 163.9° |
| OAD | CAO | NAL | H4 | 166.4° | 175.1° |
| CAK | CAP | NAL | CAO | 42.3° | 35.6° |
| CAK | CAP | NAL | CAI | 176.6° | 179.7° |
| CAK | CAP | CAI | CAH | 0.8° | 0.3° |
| CAK | CAP | NAL | H4 | 137.7° | 144.4° |
| CAK | CAP | CAI | H6 | 179.2° | 179.7° |
| CAJ | CAH | CAI | CAP | 1.2° | 0.0° |
| CAJ | CAH | CAI | H7 | 180.0° | 179.9° |
| CAJ | CAH | CAI | H6 | 178.8° | 180.0° |
| CAO | NAL | CAP | H4 | 180.0° | 180.0° |
| CAO | NAL | CAP | CAI | 134.3° | 144.6° |
| NAL | CAO | CAG | CAF | 9.4° | 164.0° |
| NAL | CAO | CAG | H3 | 170.5° | 16.0° |
| CAG | CAO | NAL | CAP | 168.6° | 175.1° |
| CAO | CAG | CAF | H3 | 180.0° | 180.0° |
| CAO | CAG | CAF | CAM | 1.9° | 25.0° |
| CAO | CAG | CAF | H2 | 178.1° | 155.0° |
| CAG | CAO | NAL | H4 | 11.4° | 4.9° |
| NAL | CAP | CAI | CAH | 176.2° | 180.0° |
| NAL | CAP | CAK | H5 | 3.3° | 0.0° |
| NAL | CAP | CAI | H6 | 3.8° | 0.0° |
| CAP | CAI | CAH | H6 | 180.0° | 180.0° |
| CAI | CAP | NAL | H4 | 45.7° | 35.3° |
| CAI | CAP | CAK | H5 | 179.8° | 179.8° |
| CAP | CAI | CAH | H7 | 178.8° | 179.9° |
| CAG | CAF | CAM | H2 | 180.0° | 180.0° |
| CAG | CAF | CAM | OAB | 9.3° | 7.1° |
| CAG | CAF | CAM | OAE | 178.6° | 173.2° |
| CAI | CAH | CAJ | H8 | 179.5° | 179.9° |
| CAF | CAM | OAB | OAE | 171.5° | 179.7° |
| CAF | CAM | OAE | H1 | 172.0° | 179.7° |
| CAM | CAF | CAG | H3 | 178.1° | 155.0° |
| OAB | CAM | OAE | H1 | 0.0° | 0.0° |
| OAB | CAM | CAF | H2 | 170.7° | 172.8° |
| OAE | CAM | CAF | H2 | 1.3° | 6.8° |
| H2 | CAF | CAG | H3 | 1.9° | 25.0° |
| H6 | CAI | CAH | H7 | 1.2° | 0.0° |
| H7 | CAH | CAJ | H8 | 0.5° | 0.0° |
