7L0
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CAV | CAU | sing | 1.51Å | 1.54Å | |
CAU | OAW | doub | 1.21Å | 1.23Å | |
CAU | NAT | sing | 1.35Å | 1.34Å | |
NAT | CAN | sing | 1.40Å | 1.35Å | |
CAN | NAO | sing | 1.33Å | 1.33Å | Aromatic |
CAN | NAM | doub | 1.32Å | 1.34Å | Aromatic |
NAO | CAE | doub | 1.33Å | 1.32Å | Aromatic |
NAM | NAD | sing | 1.40Å | 1.23Å | Aromatic |
NAD | CAC | sing | 1.36Å | 1.41Å | Aromatic |
NAD | CAE | sing | 1.37Å | 1.40Å | Aromatic |
CAC | CAB | doub | 1.36Å | 1.39Å | Aromatic |
CAE | CAF | sing | 1.41Å | 1.38Å | Aromatic |
CAF | CAG | doub | 1.36Å | 1.39Å | Aromatic |
CAG | CAB | sing | 1.41Å | 1.40Å | Aromatic |
CAB | CAA | sing | 1.48Å | 1.40Å | |
CAA | CAL | doub | 1.40Å | 1.40Å | Aromatic |
CAA | CAH | sing | 1.39Å | 1.40Å | Aromatic |
CAL | CAK | sing | 1.38Å | 1.39Å | Aromatic |
CAH | NAI | doub | 1.32Å | 1.32Å | Aromatic |
NAI | CAJ | sing | 1.32Å | 1.32Å | Aromatic |
CAJ | CAK | doub | 1.38Å | 1.39Å | Aromatic |
CAK | SAP | sing | 1.76Å | 1.77Å | |
SAP | CAQ | sing | 1.81Å | 1.78Å | |
SAP | OAS | doub | 1.42Å | 1.50Å | |
SAP | OAR | doub | 1.42Å | 1.51Å | |
CAV | HAV1 | sing | 1.09Å | 1.10Å | |
CAV | HAV2 | sing | 1.09Å | 1.10Å | |
CAV | HAV3 | sing | 1.09Å | 1.10Å | |
CAC | HAC | sing | 1.08Å | 1.08Å | |
CAF | HAF | sing | 1.08Å | 1.08Å | |
CAG | HAG | sing | 1.08Å | 1.08Å | |
CAL | HAL | sing | 1.08Å | 1.08Å | |
CAH | HAH | sing | 1.08Å | 1.08Å | |
CAJ | HAJ | sing | 1.08Å | 1.08Å | |
NAT | HAT | sing | 0.97Å | 1.00Å | |
CAQ | HAQ1 | sing | 1.09Å | 1.10Å | |
CAQ | HAQ2 | sing | 1.09Å | 1.10Å | |
CAQ | HAQ3 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CAV | CAU | OAW | 120.5° | 120.0° |
CAV | CAU | NAT | 114.5° | 120.0° |
CAU | CAV | HAV1 | 109.5° | 109.5° |
CAU | CAV | HAV2 | 109.5° | 109.4° |
CAU | CAV | HAV3 | 109.5° | 109.4° |
OAW | CAU | NAT | 125.0° | 120.0° |
CAU | NAT | CAN | 125.9° | 120.0° |
CAU | NAT | HAT | 117.1° | 120.0° |
NAT | CAN | NAO | 124.3° | 125.2° |
NAT | CAN | NAM | 125.5° | 125.3° |
CAN | NAT | HAT | 117.1° | 120.0° |
NAO | CAN | NAM | 110.1° | 109.4° |
CAN | NAO | CAE | 105.0° | 109.7° |
CAN | NAM | NAD | 109.1° | 107.1° |
NAO | CAE | NAD | 107.7° | 107.5° |
NAO | CAE | CAF | 132.7° | 132.6° |
NAM | NAD | CAC | 131.3° | 133.0° |
NAM | NAD | CAE | 108.1° | 106.3° |
CAC | NAD | CAE | 120.6° | 120.8° |
NAD | CAC | CAB | 119.5° | 120.5° |
NAD | CAC | HAC | 120.3° | 119.8° |
NAD | CAE | CAF | 119.6° | 119.9° |
CAC | CAB | CAG | 118.9° | 119.9° |
CAC | CAB | CAA | 122.1° | 120.0° |
CAB | CAC | HAC | 120.2° | 119.7° |
CAE | CAF | CAG | 119.6° | 119.5° |
CAE | CAF | HAF | 120.2° | 120.3° |
CAF | CAG | CAB | 121.7° | 119.5° |
CAG | CAF | HAF | 120.2° | 120.2° |
CAF | CAG | HAG | 119.1° | 120.3° |
CAG | CAB | CAA | 118.9° | 120.0° |
CAB | CAG | HAG | 119.2° | 120.2° |
CAB | CAA | CAL | 121.2° | 120.6° |
CAB | CAA | CAH | 119.7° | 120.5° |
CAL | CAA | CAH | 119.0° | 118.9° |
CAA | CAL | CAK | 118.2° | 118.3° |
CAA | CAL | HAL | 120.9° | 120.8° |
CAA | CAH | NAI | 121.2° | 120.6° |
CAA | CAH | HAH | 119.4° | 119.7° |
CAL | CAK | CAJ | 119.1° | 119.3° |
CAL | CAK | SAP | 122.0° | 120.3° |
CAK | CAL | HAL | 120.9° | 120.8° |
CAH | NAI | CAJ | 121.2° | 121.9° |
NAI | CAH | HAH | 119.4° | 119.7° |
NAI | CAJ | CAK | 121.3° | 121.0° |
NAI | CAJ | HAJ | 119.4° | 119.5° |
CAJ | CAK | SAP | 118.9° | 120.4° |
CAK | CAJ | HAJ | 119.4° | 119.4° |
CAK | SAP | CAQ | 109.5° | 104.4° |
CAK | SAP | OAS | 110.5° | 104.2° |
CAK | SAP | OAR | 110.2° | 104.3° |
CAQ | SAP | OAS | 108.5° | 110.6° |
CAQ | SAP | OAR | 111.0° | 110.5° |
SAP | CAQ | HAQ1 | 109.5° | 109.5° |
SAP | CAQ | HAQ2 | 109.4° | 109.4° |
SAP | CAQ | HAQ3 | 109.5° | 109.5° |
OAS | SAP | OAR | 107.1° | 121.1° |
HAV1 | CAV | HAV2 | 109.5° | 109.5° |
HAV1 | CAV | HAV3 | 109.5° | 109.5° |
HAV2 | CAV | HAV3 | 109.5° | 109.5° |
HAQ1 | CAQ | HAQ2 | 109.5° | 109.4° |
HAQ1 | CAQ | HAQ3 | 109.4° | 109.5° |
HAQ2 | CAQ | HAQ3 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CAV | CAU | OAW | NAT | 179.9° | 179.9° |
CAV | CAU | NAT | CAN | 179.5° | 180.0° |
CAU | CAV | HAV1 | HAV2 | 120.0° | 119.9° |
CAU | CAV | HAV1 | HAV3 | 120.0° | 120.0° |
CAU | CAV | HAV2 | HAV3 | 120.0° | 119.9° |
CAV | CAU | NAT | HAT | 0.5° | 0.1° |
OAW | CAU | NAT | CAN | 0.4° | 0.1° |
OAW | CAU | CAV | HAV1 | 0.0° | 90.0° |
OAW | CAU | CAV | HAV2 | 120.0° | 150.1° |
OAW | CAU | CAV | HAV3 | 120.0° | 30.1° |
OAW | CAU | NAT | HAT | 179.6° | 180.0° |
CAU | NAT | CAN | HAT | 180.0° | 179.9° |
CAU | NAT | CAN | NAO | 166.9° | 0.0° |
CAU | NAT | CAN | NAM | 13.1° | 179.7° |
NAT | CAU | CAV | HAV1 | 179.9° | 89.9° |
NAT | CAU | CAV | HAV2 | 59.9° | 30.1° |
NAT | CAU | CAV | HAV3 | 60.1° | 150.0° |
NAT | CAN | NAO | NAM | 180.0° | 179.8° |
NAT | CAN | NAO | CAE | 179.9° | 180.0° |
NAT | CAN | NAM | NAD | 180.0° | 180.0° |
NAO | CAN | NAM | NAD | 0.1° | 0.2° |
CAN | NAO | CAE | NAD | 0.2° | 0.2° |
CAN | NAO | CAE | CAF | 179.7° | 180.0° |
NAO | CAN | NAT | HAT | 13.1° | 180.0° |
NAM | CAN | NAO | CAE | 0.2° | 0.3° |
CAN | NAM | NAD | CAC | 179.9° | 180.0° |
CAN | NAM | NAD | CAE | 0.1° | 0.1° |
NAM | CAN | NAT | HAT | 166.9° | 0.2° |
NAO | CAE | NAD | NAM | 0.2° | 0.0° |
NAO | CAE | NAD | CAC | 180.0° | 179.9° |
NAO | CAE | NAD | CAF | 180.0° | 179.8° |
NAO | CAE | CAF | CAG | 179.8° | 179.9° |
NAO | CAE | CAF | HAF | 0.2° | 0.1° |
NAM | NAD | CAC | CAE | 179.8° | 179.9° |
NAM | NAD | CAC | CAB | 179.5° | 180.0° |
NAM | NAD | CAE | CAF | 179.8° | 179.8° |
NAM | NAD | CAC | HAC | 0.5° | 0.0° |
NAD | CAC | CAB | HAC | 180.0° | 180.0° |
CAC | NAD | CAE | CAF | 0.1° | 0.1° |
NAD | CAC | CAB | CAG | 0.6° | 0.2° |
NAD | CAC | CAB | CAA | 178.4° | 180.0° |
CAE | NAD | CAC | CAB | 0.2° | 0.1° |
NAD | CAE | CAF | CAG | 0.3° | 0.2° |
CAE | NAD | CAC | HAC | 179.8° | 179.9° |
NAD | CAE | CAF | HAF | 179.8° | 179.8° |
CAC | CAB | CAG | CAF | 0.8° | 0.0° |
CAC | CAB | CAG | CAA | 177.9° | 179.8° |
CAC | CAB | CAA | CAL | 28.3° | 115.0° |
CAC | CAB | CAA | CAH | 155.2° | 65.3° |
CAC | CAB | CAG | HAG | 179.2° | 179.8° |
CAE | CAF | CAG | HAF | 180.0° | 180.0° |
CAE | CAF | CAG | CAB | 0.7° | 0.1° |
CAE | CAF | CAG | HAG | 179.4° | 180.0° |
CAF | CAG | CAB | HAG | 180.0° | 179.9° |
CAF | CAG | CAB | CAA | 178.7° | 179.8° |
CAG | CAB | CAA | CAL | 149.5° | 65.2° |
CAG | CAB | CAA | CAH | 27.0° | 114.5° |
CAG | CAB | CAC | HAC | 179.4° | 179.8° |
CAB | CAG | CAF | HAF | 179.4° | 179.9° |
CAB | CAA | CAL | CAH | 176.5° | 179.8° |
CAB | CAA | CAL | CAK | 178.3° | 180.0° |
CAB | CAA | CAH | NAI | 177.9° | 180.0° |
CAA | CAB | CAC | HAC | 1.6° | 0.0° |
CAA | CAB | CAG | HAG | 1.3° | 0.0° |
CAB | CAA | CAL | HAL | 1.7° | 0.0° |
CAB | CAA | CAH | HAH | 2.2° | 0.0° |
CAA | CAL | CAK | HAL | 180.0° | 180.0° |
CAL | CAA | CAH | NAI | 1.3° | 0.3° |
CAA | CAL | CAK | CAJ | 1.1° | 0.0° |
CAA | CAL | CAK | SAP | 178.8° | 180.0° |
CAL | CAA | CAH | HAH | 178.8° | 179.8° |
CAH | CAA | CAL | CAK | 1.8° | 0.2° |
CAA | CAH | NAI | HAH | 180.0° | 180.0° |
CAA | CAH | NAI | CAJ | 0.0° | 0.1° |
CAH | CAA | CAL | HAL | 178.2° | 179.8° |
CAL | CAK | CAJ | NAI | 0.1° | 0.2° |
CAL | CAK | CAJ | SAP | 179.9° | 180.0° |
CAL | CAK | SAP | CAQ | 35.6° | 90.0° |
CAL | CAK | SAP | OAS | 155.1° | 153.9° |
CAL | CAK | SAP | OAR | 86.8° | 26.1° |
CAL | CAK | CAJ | HAJ | 179.9° | 180.0° |
CAH | NAI | CAJ | CAK | 0.6° | 0.2° |
CAH | NAI | CAJ | HAJ | 179.4° | 180.0° |
NAI | CAJ | CAK | HAJ | 180.0° | 179.8° |
NAI | CAJ | CAK | SAP | 180.0° | 179.8° |
CAJ | NAI | CAH | HAH | 180.0° | 180.0° |
CAJ | CAK | SAP | CAQ | 144.5° | 90.0° |
CAJ | CAK | SAP | OAS | 25.0° | 26.1° |
CAJ | CAK | SAP | OAR | 93.1° | 153.9° |
CAJ | CAK | CAL | HAL | 178.9° | 180.0° |
CAK | SAP | CAQ | OAS | 120.7° | 111.6° |
CAK | SAP | CAQ | OAR | 121.8° | 111.6° |
CAK | SAP | OAS | OAR | 120.0° | 116.7° |
SAP | CAK | CAL | HAL | 1.2° | 0.0° |
SAP | CAK | CAJ | HAJ | 0.0° | 0.0° |
CAK | SAP | CAQ | HAQ1 | 180.0° | 60.1° |
CAK | SAP | CAQ | HAQ2 | 60.0° | 179.9° |
CAK | SAP | CAQ | HAQ3 | 60.0° | 60.0° |
CAQ | SAP | OAS | OAR | 119.9° | 131.6° |
SAP | CAQ | HAQ1 | HAQ2 | 120.0° | 119.9° |
SAP | CAQ | HAQ1 | HAQ3 | 120.0° | 120.1° |
SAP | CAQ | HAQ2 | HAQ3 | 120.0° | 120.0° |
OAS | SAP | CAQ | HAQ1 | 59.3° | 51.5° |
OAS | SAP | CAQ | HAQ2 | 60.7° | 68.4° |
OAS | SAP | CAQ | HAQ3 | 179.3° | 171.6° |
OAR | SAP | CAQ | HAQ1 | 58.2° | 171.7° |
OAR | SAP | CAQ | HAQ2 | 178.2° | 68.5° |
OAR | SAP | CAQ | HAQ3 | 61.8° | 51.6° |
HAV1 | CAV | HAV2 | HAV3 | 120.0° | 120.1° |
HAF | CAF | CAG | HAG | 0.6° | 0.0° |
HAQ1 | CAQ | HAQ2 | HAQ3 | 120.0° | 120.1° |