RXA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAA | CAI | doub | 1.21Å | 1.26Å | |
| CAI | NAH | sing | 1.34Å | 1.37Å | |
| CAI | CAK | sing | 1.50Å | 1.39Å | |
| NAH | CAJ | sing | 1.34Å | 1.37Å | |
| CAK | OAC | doub | 1.21Å | 1.25Å | |
| CAK | CAM | sing | 1.48Å | 1.41Å | |
| CAM | CAL | doub | 1.41Å | 1.41Å | Aromatic |
| CAM | CAG | sing | 1.39Å | 1.40Å | Aromatic |
| CAL | CAF | sing | 1.39Å | 1.41Å | Aromatic |
| CAL | CAJ | sing | 1.48Å | 1.42Å | |
| CAF | CAD | doub | 1.38Å | 1.41Å | Aromatic |
| CAJ | OAB | doub | 1.21Å | 1.28Å | |
| CAG | CAE | doub | 1.38Å | 1.41Å | Aromatic |
| CAE | CAD | sing | 1.38Å | 1.41Å | Aromatic |
| NAH | HNAH | sing | 0.97Å | 1.00Å | |
| CAF | HAF | sing | 1.08Å | 1.08Å | |
| CAG | HAG | sing | 1.08Å | 1.08Å | |
| CAE | HAE | sing | 1.08Å | 1.08Å | |
| CAD | HAD | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAA | CAI | NAH | 122.9° | 119.9° |
| OAA | CAI | CAK | 116.8° | 119.9° |
| NAH | CAI | CAK | 120.3° | 120.2° |
| CAI | NAH | CAJ | 121.9° | 122.9° |
| CAI | NAH | HNAH | 119.0° | 118.6° |
| CAI | CAK | OAC | 116.8° | 121.1° |
| CAI | CAK | CAM | 120.0° | 117.9° |
| NAH | CAJ | CAL | 119.1° | 121.4° |
| NAH | CAJ | OAB | 120.4° | 119.3° |
| CAJ | NAH | HNAH | 119.0° | 118.5° |
| OAC | CAK | CAM | 123.2° | 121.0° |
| CAK | CAM | CAL | 119.3° | 118.2° |
| CAK | CAM | CAG | 121.0° | 121.7° |
| CAL | CAM | CAG | 119.7° | 120.1° |
| CAM | CAL | CAF | 119.6° | 119.5° |
| CAM | CAL | CAJ | 119.4° | 119.3° |
| CAM | CAG | CAE | 121.0° | 119.5° |
| CAM | CAG | HAG | 119.5° | 120.2° |
| CAF | CAL | CAJ | 121.0° | 121.2° |
| CAL | CAF | CAD | 120.5° | 119.7° |
| CAL | CAF | HAF | 119.7° | 120.1° |
| CAL | CAJ | OAB | 120.5° | 119.3° |
| CAF | CAD | CAE | 119.5° | 120.7° |
| CAD | CAF | HAF | 119.8° | 120.1° |
| CAF | CAD | HAD | 120.2° | 119.7° |
| CAG | CAE | CAD | 119.5° | 120.5° |
| CAE | CAG | HAG | 119.5° | 120.2° |
| CAG | CAE | HAE | 120.2° | 119.8° |
| CAD | CAE | HAE | 120.2° | 119.8° |
| CAE | CAD | HAD | 120.2° | 119.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAA | CAI | NAH | CAK | 179.7° | 179.8° |
| OAA | CAI | NAH | CAJ | 179.8° | 180.0° |
| OAA | CAI | CAK | OAC | 0.3° | 0.0° |
| OAA | CAI | CAK | CAM | 179.6° | 180.0° |
| OAA | CAI | NAH | HNAH | 0.2° | 0.1° |
| CAI | NAH | CAJ | HNAH | 180.0° | 180.0° |
| NAH | CAI | CAK | OAC | 179.4° | 179.7° |
| NAH | CAI | CAK | CAM | 0.2° | 0.2° |
| CAI | NAH | CAJ | CAL | 1.0° | 0.0° |
| CAI | NAH | CAJ | OAB | 179.4° | 180.0° |
| CAK | CAI | NAH | CAJ | 0.4° | 0.2° |
| CAI | CAK | OAC | CAM | 179.2° | 180.0° |
| CAI | CAK | CAM | CAL | 0.2° | 0.1° |
| CAI | CAK | CAM | CAG | 179.1° | 180.0° |
| CAK | CAI | NAH | HNAH | 179.6° | 179.7° |
| NAH | CAJ | CAL | CAM | 0.9° | 0.3° |
| NAH | CAJ | CAL | CAF | 179.8° | 180.0° |
| NAH | CAJ | CAL | OAB | 179.7° | 179.9° |
| OAC | CAK | CAM | CAL | 179.4° | 180.0° |
| OAC | CAK | CAM | CAG | 0.0° | 0.0° |
| CAK | CAM | CAL | CAG | 179.4° | 180.0° |
| CAK | CAM | CAL | CAF | 179.6° | 180.0° |
| CAK | CAM | CAL | CAJ | 0.3° | 0.3° |
| CAK | CAM | CAG | CAE | 179.7° | 180.0° |
| CAK | CAM | CAG | HAG | 0.3° | 0.0° |
| CAM | CAL | CAF | CAJ | 179.3° | 179.7° |
| CAM | CAL | CAF | CAD | 0.2° | 0.0° |
| CAM | CAL | CAJ | OAB | 179.4° | 179.8° |
| CAL | CAM | CAG | CAE | 0.9° | 0.0° |
| CAM | CAL | CAF | HAF | 179.8° | 180.0° |
| CAL | CAM | CAG | HAG | 179.1° | 180.0° |
| CAG | CAM | CAL | CAF | 1.0° | 0.0° |
| CAG | CAM | CAL | CAJ | 179.7° | 179.7° |
| CAM | CAG | CAE | HAG | 180.0° | 180.0° |
| CAM | CAG | CAE | CAD | 0.0° | 0.0° |
| CAM | CAG | CAE | HAE | 180.0° | 180.0° |
| CAL | CAF | CAD | HAF | 180.0° | 180.0° |
| CAF | CAL | CAJ | OAB | 0.2° | 0.1° |
| CAL | CAF | CAD | CAE | 0.7° | 0.0° |
| CAL | CAF | CAD | HAD | 179.3° | 180.0° |
| CAJ | CAL | CAF | CAD | 179.5° | 179.7° |
| CAL | CAJ | NAH | HNAH | 179.0° | 180.0° |
| CAJ | CAL | CAF | HAF | 0.5° | 0.3° |
| CAF | CAD | CAE | CAG | 0.8° | 0.0° |
| CAF | CAD | CAE | HAD | 180.0° | 180.0° |
| CAF | CAD | CAE | HAE | 179.2° | 180.0° |
| OAB | CAJ | NAH | HNAH | 0.6° | 0.1° |
| CAG | CAE | CAD | HAE | 180.0° | 180.0° |
| CAG | CAE | CAD | HAD | 179.2° | 180.0° |
| CAE | CAD | CAF | HAF | 179.3° | 180.0° |
| CAD | CAE | CAG | HAG | 180.0° | 180.0° |
| HAF | CAF | CAD | HAD | 0.7° | 0.0° |
| HAG | CAG | CAE | HAE | 0.0° | 0.0° |
| HAE | CAE | CAD | HAD | 0.8° | 0.0° |
