OR7
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CAA | CAC | sing | 1.51Å | 1.47Å | |
CAU | OAT | sing | 1.43Å | 1.46Å | |
OAD | CAC | doub | 1.21Å | 1.22Å | |
CAC | NAE | sing | 1.35Å | 1.38Å | |
NAE | CAF | sing | 1.40Å | 1.35Å | |
OAT | CAS | sing | 1.43Å | 1.46Å | |
CAS | CAR | sing | 1.53Å | 1.57Å | |
CAF | CAG | doub | 1.39Å | 1.40Å | Aromatic |
CAF | CAH | sing | 1.39Å | 1.43Å | Aromatic |
CAG | CAI | sing | 1.38Å | 1.39Å | Aromatic |
CAH | CAJ | doub | 1.38Å | 1.40Å | Aromatic |
CAI | CAK | doub | 1.38Å | 1.42Å | Aromatic |
CAR | NAP | sing | 1.47Å | 1.49Å | |
CAJ | CAK | sing | 1.38Å | 1.40Å | Aromatic |
CAJ | SAM | sing | 1.76Å | 2.03Å | |
CAK | CLA | sing | 1.74Å | 1.67Å | |
CAQ | NAP | sing | 1.46Å | 1.48Å | |
NAP | SAM | sing | 1.66Å | 1.80Å | |
OAO | SAM | doub | 1.42Å | 1.56Å | |
SAM | OAN | doub | 1.42Å | 1.53Å | |
CAA | H1 | sing | 1.09Å | 1.10Å | |
CAA | H2 | sing | 1.09Å | 1.10Å | |
NAE | H4 | sing | 0.97Å | 1.00Å | |
CAH | H5 | sing | 1.08Å | 1.08Å | |
CAG | H6 | sing | 1.08Å | 1.08Å | |
CAI | H7 | sing | 1.08Å | 1.08Å | |
CAQ | H8 | sing | 1.09Å | 1.10Å | |
CAQ | H9 | sing | 1.09Å | 1.10Å | |
CAQ | H10 | sing | 1.09Å | 1.10Å | |
CAR | H11 | sing | 1.09Å | 1.10Å | |
CAR | H12 | sing | 1.09Å | 1.10Å | |
CAS | H13 | sing | 1.09Å | 1.10Å | |
CAS | H14 | sing | 1.09Å | 1.10Å | |
CAU | H15 | sing | 1.09Å | 1.10Å | |
CAU | H16 | sing | 1.09Å | 1.10Å | |
CAU | H17 | sing | 1.09Å | 1.10Å | |
CAA | CL1 | sing | 1.80Å | 1.78Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CAA | CAC | OAD | 116.8° | 120.0° |
CAA | CAC | NAE | 114.8° | 120.0° |
CAC | CAA | H1 | 109.3° | 109.4° |
CAC | CAA | H2 | 109.3° | 109.5° |
CAC | CAA | CL1 | 110.2° | 109.5° |
CAU | OAT | CAS | 108.1° | 114.0° |
OAT | CAU | H15 | 109.5° | 109.5° |
OAT | CAU | H16 | 109.5° | 109.5° |
OAT | CAU | H17 | 109.5° | 109.5° |
OAD | CAC | NAE | 127.9° | 120.0° |
CAC | NAE | CAF | 120.3° | 120.0° |
CAC | NAE | H4 | 119.9° | 120.0° |
NAE | CAF | CAG | 119.8° | 120.1° |
NAE | CAF | CAH | 120.8° | 120.0° |
CAF | NAE | H4 | 119.9° | 120.0° |
OAT | CAS | CAR | 116.3° | 109.5° |
OAT | CAS | H13 | 107.8° | 109.4° |
OAT | CAS | H14 | 107.8° | 109.5° |
CAS | CAR | NAP | 110.6° | 109.4° |
CAS | CAR | H11 | 109.2° | 109.5° |
CAS | CAR | H12 | 109.2° | 109.5° |
CAR | CAS | H13 | 107.8° | 109.5° |
CAR | CAS | H14 | 107.7° | 109.5° |
CAG | CAF | CAH | 119.3° | 119.9° |
CAF | CAG | CAI | 118.3° | 119.9° |
CAF | CAG | H6 | 120.9° | 120.1° |
CAF | CAH | CAJ | 123.6° | 119.9° |
CAF | CAH | H5 | 118.2° | 120.1° |
CAG | CAI | CAK | 121.2° | 120.1° |
CAI | CAG | H6 | 120.8° | 120.0° |
CAG | CAI | H7 | 119.4° | 120.0° |
CAH | CAJ | CAK | 115.1° | 120.1° |
CAH | CAJ | SAM | 122.0° | 120.0° |
CAJ | CAH | H5 | 118.2° | 120.0° |
CAI | CAK | CAJ | 122.4° | 120.0° |
CAI | CAK | CLA | 119.8° | 120.0° |
CAK | CAI | H7 | 119.4° | 119.9° |
CAR | NAP | CAQ | 114.4° | 120.0° |
CAR | NAP | SAM | 109.8° | 120.0° |
NAP | CAR | H11 | 109.2° | 109.5° |
NAP | CAR | H12 | 109.2° | 109.5° |
CAK | CAJ | SAM | 122.9° | 119.9° |
CAJ | CAK | CLA | 117.8° | 120.0° |
CAJ | SAM | NAP | 118.9° | 107.2° |
CAJ | SAM | OAO | 115.5° | 106.4° |
CAJ | SAM | OAN | 106.3° | 106.4° |
CAQ | NAP | SAM | 114.0° | 120.0° |
NAP | CAQ | H8 | 109.5° | 109.4° |
NAP | CAQ | H9 | 109.5° | 109.5° |
NAP | CAQ | H10 | 109.5° | 109.5° |
NAP | SAM | OAO | 98.5° | 106.4° |
NAP | SAM | OAN | 106.5° | 106.4° |
OAO | SAM | OAN | 110.8° | 123.2° |
H1 | CAA | H2 | 109.5° | 109.5° |
H1 | CAA | CL1 | 109.3° | 109.5° |
H2 | CAA | CL1 | 109.3° | 109.5° |
H8 | CAQ | H9 | 109.5° | 109.5° |
H8 | CAQ | H10 | 109.4° | 109.5° |
H9 | CAQ | H10 | 109.5° | 109.5° |
H11 | CAR | H12 | 109.5° | 109.5° |
H13 | CAS | H14 | 109.4° | 109.4° |
H15 | CAU | H16 | 109.5° | 109.4° |
H15 | CAU | H17 | 109.4° | 109.5° |
H16 | CAU | H17 | 109.4° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CAA | CAC | OAD | NAE | 171.3° | 179.9° |
CAA | CAC | NAE | CAF | 174.7° | 175.4° |
CAC | CAA | H1 | H2 | 119.6° | 120.0° |
CAC | CAA | H1 | CL1 | 120.7° | 120.0° |
CAC | CAA | H2 | CL1 | 120.7° | 120.0° |
CAA | CAC | NAE | H4 | 5.3° | 4.6° |
CAU | OAT | CAS | CAR | 168.3° | 180.0° |
CAU | OAT | CAS | H13 | 47.3° | 60.0° |
CAU | OAT | CAS | H14 | 70.7° | 60.0° |
OAT | CAU | H15 | H16 | 120.0° | 120.0° |
OAT | CAU | H15 | H17 | 120.0° | 120.0° |
OAT | CAU | H16 | H17 | 120.0° | 120.0° |
OAD | CAC | NAE | CAF | 13.8° | 4.7° |
OAD | CAC | CAA | H1 | 178.0° | 120.1° |
OAD | CAC | CAA | H2 | 58.3° | 120.0° |
OAD | CAC | NAE | H4 | 166.1° | 175.3° |
OAD | CAC | CAA | CL1 | 61.9° | 0.1° |
CAC | NAE | CAF | H4 | 180.0° | 180.0° |
CAC | NAE | CAF | CAG | 160.2° | 35.2° |
CAC | NAE | CAF | CAH | 23.5° | 144.5° |
NAE | CAC | CAA | H1 | 5.6° | 60.0° |
NAE | CAC | CAA | H2 | 114.2° | 59.9° |
NAE | CAC | CAA | CL1 | 125.7° | 180.0° |
NAE | CAF | CAG | CAH | 176.3° | 179.7° |
NAE | CAF | CAG | CAI | 178.4° | 179.9° |
NAE | CAF | CAH | CAJ | 179.3° | 179.9° |
NAE | CAF | CAH | H5 | 0.7° | 0.0° |
NAE | CAF | CAG | H6 | 1.6° | 0.0° |
OAT | CAS | CAR | H13 | 121.0° | 120.0° |
OAT | CAS | CAR | H14 | 121.0° | 120.0° |
OAT | CAS | CAR | NAP | 105.2° | 65.0° |
OAT | CAS | CAR | H11 | 15.0° | 54.9° |
OAT | CAS | CAR | H12 | 134.6° | 175.0° |
OAT | CAS | H13 | H14 | 116.9° | 120.0° |
CAS | OAT | CAU | H15 | 180.0° | 60.0° |
CAS | OAT | CAU | H16 | 60.0° | 60.0° |
CAS | OAT | CAU | H17 | 60.0° | 180.0° |
CAS | CAR | NAP | H11 | 120.2° | 120.0° |
CAS | CAR | NAP | H12 | 120.2° | 120.0° |
CAS | CAR | NAP | CAQ | 67.8° | 85.0° |
CAS | CAR | NAP | SAM | 61.8° | 95.0° |
CAS | CAR | H11 | H12 | 119.5° | 120.0° |
CAR | CAS | H13 | H14 | 116.9° | 120.0° |
CAF | CAG | CAI | H6 | 180.0° | 179.9° |
CAG | CAF | CAH | CAJ | 3.0° | 0.2° |
CAF | CAG | CAI | CAK | 0.8° | 0.1° |
CAG | CAF | NAE | H4 | 19.7° | 144.8° |
CAG | CAF | CAH | H5 | 177.0° | 179.8° |
CAF | CAG | CAI | H7 | 179.2° | 180.0° |
CAH | CAF | CAG | CAI | 2.0° | 0.2° |
CAF | CAH | CAJ | H5 | 180.0° | 180.0° |
CAF | CAH | CAJ | CAK | 2.4° | 0.0° |
CAF | CAH | CAJ | SAM | 178.8° | 180.0° |
CAH | CAF | NAE | H4 | 156.5° | 35.5° |
CAH | CAF | CAG | H6 | 178.0° | 179.7° |
CAG | CAI | CAK | H7 | 180.0° | 179.9° |
CAG | CAI | CAK | CAJ | 0.3° | 0.3° |
CAG | CAI | CAK | CLA | 178.7° | 180.0° |
CAH | CAJ | CAK | CAI | 1.1° | 0.3° |
CAH | CAJ | CAK | SAM | 178.7° | 179.9° |
CAH | CAJ | CAK | CLA | 179.5° | 180.0° |
CAH | CAJ | SAM | NAP | 113.2° | 14.6° |
CAH | CAJ | SAM | OAO | 3.6° | 128.1° |
CAH | CAJ | SAM | OAN | 126.9° | 98.9° |
CAI | CAK | CAJ | CLA | 178.5° | 179.7° |
CAI | CAK | CAJ | SAM | 179.8° | 179.8° |
CAK | CAI | CAG | H6 | 179.2° | 180.0° |
CAR | NAP | SAM | CAJ | 90.0° | 95.4° |
CAR | NAP | CAQ | SAM | 127.5° | 180.0° |
CAR | NAP | SAM | OAO | 35.4° | 18.1° |
CAR | NAP | SAM | OAN | 150.2° | 151.0° |
CAR | NAP | CAQ | H8 | 180.0° | 85.1° |
CAR | NAP | CAQ | H9 | 60.0° | 34.9° |
CAR | NAP | CAQ | H10 | 60.0° | 155.0° |
NAP | CAR | H11 | H12 | 119.4° | 120.0° |
NAP | CAR | CAS | H13 | 133.8° | 175.0° |
NAP | CAR | CAS | H14 | 15.8° | 55.0° |
CAK | CAJ | SAM | NAP | 68.2° | 165.3° |
CAK | CAJ | SAM | OAO | 175.1° | 51.8° |
CAK | CAJ | SAM | OAN | 51.7° | 81.2° |
CAK | CAJ | CAH | H5 | 177.6° | 180.0° |
CAJ | CAK | CAI | H7 | 179.7° | 179.8° |
SAM | CAJ | CAK | CLA | 1.7° | 0.0° |
CAJ | SAM | NAP | CAQ | 39.9° | 84.6° |
CAJ | SAM | NAP | OAO | 125.4° | 113.6° |
CAJ | SAM | NAP | OAN | 119.8° | 113.5° |
CAJ | SAM | OAO | OAN | 120.9° | 123.0° |
SAM | CAJ | CAH | H5 | 1.2° | 0.1° |
CLA | CAK | CAI | H7 | 1.3° | 0.0° |
CAQ | NAP | SAM | OAO | 165.3° | 161.9° |
CAQ | NAP | SAM | OAN | 79.9° | 29.0° |
NAP | CAQ | H8 | H9 | 120.0° | 120.0° |
NAP | CAQ | H8 | H10 | 120.0° | 120.0° |
NAP | CAQ | H9 | H10 | 120.0° | 120.0° |
CAQ | NAP | CAR | H11 | 172.0° | 35.0° |
CAQ | NAP | CAR | H12 | 52.4° | 155.0° |
NAP | SAM | OAO | OAN | 111.4° | 122.9° |
SAM | NAP | CAQ | H8 | 52.5° | 94.9° |
SAM | NAP | CAQ | H9 | 172.5° | 145.1° |
SAM | NAP | CAQ | H10 | 67.5° | 25.0° |
SAM | NAP | CAR | H11 | 58.4° | 145.0° |
SAM | NAP | CAR | H12 | 178.0° | 25.0° |
H1 | CAA | H2 | CL1 | 119.6° | 120.0° |
H6 | CAG | CAI | H7 | 0.8° | 0.1° |
H8 | CAQ | H9 | H10 | 120.0° | 120.0° |
H11 | CAR | CAS | H13 | 106.1° | 65.0° |
H11 | CAR | CAS | H14 | 136.0° | 175.0° |
H12 | CAR | CAS | H13 | 13.6° | 55.0° |
H12 | CAR | CAS | H14 | 104.4° | 65.0° |
H15 | CAU | H16 | H17 | 120.0° | 120.0° |