OA7
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
OAJ | CAG | doub | 1.22Å | 1.26Å | |
OAI | CAG | sing | 1.35Å | 1.26Å | |
CAG | CAF | sing | 1.48Å | 1.53Å | |
CAE | CAF | doub | 1.40Å | 1.38Å | Aromatic |
CAE | NAD | sing | 1.32Å | 1.32Å | Aromatic |
CAF | CAA | sing | 1.40Å | 1.39Å | Aromatic |
NAD | CAC | doub | 1.33Å | 1.32Å | Aromatic |
CAA | CAB | doub | 1.37Å | 1.39Å | Aromatic |
CAC | CAB | sing | 1.39Å | 1.38Å | Aromatic |
CAC | OAH | sing | 1.36Å | 1.40Å | |
CAA | H1 | sing | 1.08Å | 1.08Å | |
CAB | H2 | sing | 1.08Å | 1.08Å | |
CAE | H4 | sing | 1.08Å | 1.08Å | |
OAI | H5 | sing | 0.97Å | 0.95Å | |
OAH | H3 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
OAJ | CAG | OAI | 119.9° | 120.0° |
OAJ | CAG | CAF | 119.4° | 120.0° |
OAI | CAG | CAF | 120.7° | 120.0° |
CAG | OAI | H5 | 109.5° | 117.0° |
CAG | CAF | CAE | 120.5° | 120.5° |
CAG | CAF | CAA | 121.3° | 120.5° |
CAF | CAE | NAD | 120.2° | 120.5° |
CAE | CAF | CAA | 118.2° | 119.0° |
CAF | CAE | H4 | 119.9° | 119.8° |
CAE | NAD | CAC | 123.3° | 121.7° |
NAD | CAE | H4 | 119.9° | 119.7° |
CAF | CAA | CAB | 120.0° | 118.5° |
CAF | CAA | H1 | 120.0° | 120.7° |
NAD | CAC | CAB | 119.9° | 121.0° |
NAD | CAC | OAH | 119.9° | 119.5° |
CAA | CAB | CAC | 118.4° | 119.4° |
CAB | CAA | H1 | 120.0° | 120.8° |
CAA | CAB | H2 | 120.8° | 120.3° |
CAB | CAC | OAH | 120.2° | 119.5° |
CAC | CAB | H2 | 120.8° | 120.3° |
CAC | OAH | H3 | 109.5° | 114.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
OAJ | CAG | OAI | CAF | 179.0° | 180.0° |
OAJ | CAG | CAF | CAE | 18.4° | 180.0° |
OAJ | CAG | CAF | CAA | 161.5° | 0.6° |
OAJ | CAG | OAI | H5 | 0.0° | 0.1° |
OAI | CAG | CAF | CAE | 162.6° | 0.0° |
OAI | CAG | CAF | CAA | 17.5° | 179.4° |
CAG | CAF | CAE | CAA | 179.9° | 179.4° |
CAG | CAF | CAE | NAD | 179.7° | 180.0° |
CAG | CAF | CAA | CAB | 179.8° | 179.5° |
CAG | CAF | CAA | H1 | 0.2° | 0.3° |
CAG | CAF | CAE | H4 | 0.3° | 0.5° |
CAF | CAG | OAI | H5 | 179.0° | 179.9° |
CAF | CAE | NAD | H4 | 180.0° | 179.6° |
CAF | CAE | NAD | CAC | 0.3° | 0.8° |
CAE | CAF | CAA | CAB | 0.1° | 0.0° |
CAE | CAF | CAA | H1 | 179.9° | 179.7° |
NAD | CAE | CAF | CAA | 0.1° | 0.6° |
CAE | NAD | CAC | CAB | 0.3° | 0.5° |
CAE | NAD | CAC | OAH | 179.9° | 179.5° |
CAF | CAA | CAB | H1 | 180.0° | 179.8° |
CAF | CAA | CAB | CAC | 0.1° | 0.2° |
CAF | CAA | CAB | H2 | 179.9° | 179.8° |
CAA | CAF | CAE | H4 | 179.9° | 179.9° |
NAD | CAC | CAB | CAA | 0.2° | 0.0° |
NAD | CAC | CAB | OAH | 179.8° | 180.0° |
NAD | CAC | CAB | H2 | 179.8° | 180.0° |
CAC | NAD | CAE | H4 | 179.8° | 179.7° |
NAD | CAC | OAH | H3 | 0.0° | 90.0° |
CAA | CAB | CAC | H2 | 180.0° | 180.0° |
CAA | CAB | CAC | OAH | 180.0° | 180.0° |
CAC | CAB | CAA | H1 | 179.9° | 180.0° |
CAB | CAC | OAH | H3 | 179.8° | 90.0° |
OAH | CAC | CAB | H2 | 0.0° | 0.0° |
H1 | CAA | CAB | H2 | 0.1° | 0.0° |