G9P
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CAN | N11 | sing | 1.35Å | 1.38Å | |
N11 | CAK | sing | 1.46Å | 1.51Å | |
N11 | HN11 | sing | 0.97Å | 1.00Å | |
OAA | CAN | doub | 1.22Å | 1.24Å | |
SAV | OAB | sing | 1.52Å | 1.52Å | |
OAB | HOAB | sing | 0.97Å | 0.95Å | |
SAV | OAC | doub | 1.42Å | 1.50Å | |
OAD | SAV | doub | 1.42Å | 1.44Å | |
CAG | CAE | doub | 1.38Å | 1.42Å | Aromatic |
CAE | CAF | sing | 1.38Å | 1.41Å | Aromatic |
CAE | HAE | sing | 1.08Å | 1.08Å | |
CAF | CAQ | doub | 1.39Å | 1.38Å | Aromatic |
CAF | HAF | sing | 1.08Å | 1.08Å | |
CAG | CAR | sing | 1.39Å | 1.39Å | Aromatic |
CAG | HAG | sing | 1.08Å | 1.08Å | |
CAI | CAH | doub | 1.38Å | 1.39Å | Aromatic |
CAO | CAH | sing | 1.38Å | 1.39Å | Aromatic |
CAH | HAH | sing | 1.08Å | 1.08Å | |
CAP | CAI | sing | 1.39Å | 1.39Å | Aromatic |
CAI | HAI | sing | 1.08Å | 1.08Å | |
CAS | CAJ | sing | 1.38Å | 1.40Å | Aromatic |
CAJ | CAO | doub | 1.38Å | 1.39Å | Aromatic |
CAJ | HAJ | sing | 1.08Å | 1.08Å | |
CAK | CAU | sing | 1.53Å | 1.54Å | |
CAK | HAK | sing | 1.09Å | 1.10Å | |
CAK | HAKA | sing | 1.09Å | 1.10Å | |
CAQ | OAM | sing | 1.36Å | 1.38Å | |
OAM | CAP | sing | 1.36Å | 1.37Å | |
CAN | CAR | sing | 1.48Å | 1.41Å | |
CAO | SAV | sing | 1.76Å | 1.73Å | |
CAS | CAP | doub | 1.39Å | 1.39Å | Aromatic |
CAT | CAQ | sing | 1.38Å | 1.42Å | Aromatic |
CAR | CAT | doub | 1.39Å | 1.40Å | Aromatic |
CAU | CAS | sing | 1.51Å | 1.54Å | |
CAT | CAU | sing | 1.50Å | 1.54Å | |
CAU | HAU | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CAN | N11 | CAK | 122.0° | 121.1° |
CAN | N11 | HN11 | 119.0° | 119.4° |
N11 | CAN | OAA | 120.1° | 120.7° |
N11 | CAN | CAR | 119.6° | 118.7° |
CAK | N11 | HN11 | 119.0° | 119.4° |
N11 | CAK | CAU | 111.3° | 110.7° |
N11 | CAK | HAK | 108.9° | 109.2° |
N11 | CAK | HAKA | 108.9° | 109.3° |
OAA | CAN | CAR | 120.1° | 120.7° |
SAV | OAB | HOAB | 109.5° | 114.1° |
OAB | SAV | OAC | 105.6° | 106.4° |
OAB | SAV | OAD | 111.9° | 106.4° |
OAB | SAV | CAO | 108.9° | 107.3° |
OAC | SAV | OAD | 115.3° | 123.1° |
OAC | SAV | CAO | 108.6° | 106.4° |
OAD | SAV | CAO | 106.4° | 106.4° |
CAG | CAE | CAF | 118.3° | 120.4° |
CAG | CAE | HAE | 120.8° | 119.7° |
CAE | CAG | CAR | 121.2° | 119.6° |
CAE | CAG | HAG | 119.4° | 120.2° |
CAF | CAE | HAE | 120.9° | 119.8° |
CAE | CAF | CAQ | 121.3° | 120.3° |
CAE | CAF | HAF | 119.3° | 119.8° |
CAQ | CAF | HAF | 119.4° | 119.9° |
CAF | CAQ | OAM | 120.7° | 120.6° |
CAF | CAQ | CAT | 119.9° | 119.7° |
CAR | CAG | HAG | 119.4° | 120.3° |
CAG | CAR | CAN | 120.1° | 121.5° |
CAG | CAR | CAT | 119.8° | 120.0° |
CAI | CAH | CAO | 120.8° | 120.2° |
CAI | CAH | HAH | 119.6° | 120.0° |
CAH | CAI | CAP | 119.9° | 119.7° |
CAH | CAI | HAI | 120.0° | 120.0° |
CAO | CAH | HAH | 119.6° | 119.8° |
CAH | CAO | CAJ | 120.0° | 120.1° |
CAH | CAO | SAV | 119.1° | 120.0° |
CAP | CAI | HAI | 120.0° | 120.3° |
CAI | CAP | OAM | 118.1° | 120.0° |
CAI | CAP | CAS | 119.5° | 120.0° |
CAS | CAJ | CAO | 118.9° | 120.0° |
CAS | CAJ | HAJ | 120.6° | 120.0° |
CAJ | CAS | CAP | 120.8° | 120.1° |
CAJ | CAS | CAU | 121.5° | 120.1° |
CAO | CAJ | HAJ | 120.6° | 120.0° |
CAJ | CAO | SAV | 120.9° | 119.9° |
CAU | CAK | HAK | 108.9° | 109.2° |
CAU | CAK | HAKA | 108.8° | 109.2° |
CAK | CAU | CAS | 111.3° | 109.1° |
CAK | CAU | CAT | 109.8° | 109.3° |
CAK | CAU | HAU | 107.6° | 109.7° |
HAK | CAK | HAKA | 110.1° | 109.2° |
CAQ | OAM | CAP | 116.3° | 117.6° |
OAM | CAQ | CAT | 119.4° | 119.7° |
OAM | CAP | CAS | 122.4° | 120.0° |
CAN | CAR | CAT | 120.0° | 118.5° |
CAP | CAS | CAU | 117.7° | 119.9° |
CAQ | CAT | CAR | 119.6° | 120.0° |
CAQ | CAT | CAU | 118.8° | 120.6° |
CAR | CAT | CAU | 121.6° | 119.4° |
CAS | CAU | CAT | 108.2° | 108.6° |
CAS | CAU | HAU | 109.2° | 110.6° |
CAT | CAU | HAU | 110.8° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CAN | N11 | CAK | HN11 | 180.0° | 179.7° |
N11 | CAN | OAA | CAR | 174.7° | 180.0° |
N11 | CAN | CAR | CAG | 168.3° | 159.3° |
CAN | N11 | CAK | CAU | 35.8° | 37.5° |
CAN | N11 | CAK | HAK | 84.1° | 82.7° |
CAN | N11 | CAK | HAKA | 155.8° | 157.9° |
N11 | CAN | CAR | CAT | 14.0° | 21.0° |
CAK | N11 | CAN | OAA | 179.5° | 179.6° |
N11 | CAK | CAU | HAK | 120.0° | 120.3° |
N11 | CAK | CAU | HAKA | 120.0° | 120.4° |
N11 | CAK | HAK | HAKA | 119.3° | 119.5° |
CAK | N11 | CAN | CAR | 5.8° | 0.3° |
N11 | CAK | CAU | CAS | 163.4° | 171.0° |
N11 | CAK | CAU | CAT | 43.7° | 52.4° |
N11 | CAK | CAU | HAU | 77.0° | 67.6° |
HN11 | N11 | CAN | OAA | 0.4° | 0.7° |
HN11 | N11 | CAK | CAU | 144.2° | 142.1° |
HN11 | N11 | CAK | HAK | 95.9° | 97.6° |
HN11 | N11 | CAK | HAKA | 24.2° | 21.8° |
HN11 | N11 | CAN | CAR | 174.2° | 179.3° |
OAA | CAN | CAR | CAG | 17.0° | 20.7° |
OAA | CAN | CAR | CAT | 160.7° | 159.1° |
OAB | SAV | OAC | OAD | 124.1° | 122.9° |
OAB | SAV | OAC | CAO | 116.6° | 114.1° |
OAB | SAV | OAD | CAO | 118.8° | 114.2° |
OAB | SAV | CAO | CAH | 1.3° | 90.0° |
OAB | SAV | CAO | CAJ | 178.2° | 90.0° |
HOAB | OAB | SAV | OAC | 0.0° | 66.5° |
HOAB | OAB | SAV | OAD | 126.3° | 66.4° |
HOAB | OAB | SAV | CAO | 116.4° | 180.0° |
OAC | SAV | OAD | CAO | 120.4° | 122.9° |
OAC | SAV | CAO | CAH | 115.8° | 156.5° |
OAC | SAV | CAO | CAJ | 63.7° | 23.6° |
OAD | SAV | CAO | CAH | 119.5° | 23.6° |
OAD | SAV | CAO | CAJ | 61.0° | 156.5° |
CAG | CAE | CAF | HAE | 180.0° | 180.0° |
CAG | CAE | CAF | CAQ | 0.9° | 0.2° |
CAG | CAE | CAF | HAF | 179.1° | 179.7° |
CAE | CAG | CAR | HAG | 180.0° | 180.0° |
CAE | CAG | CAR | CAN | 179.1° | 179.5° |
CAE | CAG | CAR | CAT | 1.4° | 0.3° |
CAE | CAF | CAQ | HAF | 180.0° | 179.9° |
CAF | CAE | CAG | CAR | 1.0° | 0.1° |
CAF | CAE | CAG | HAG | 179.0° | 179.8° |
CAE | CAF | CAQ | OAM | 179.0° | 179.6° |
CAE | CAF | CAQ | CAT | 2.3° | 0.2° |
HAE | CAE | CAF | CAQ | 179.1° | 179.8° |
HAE | CAE | CAF | HAF | 0.9° | 0.3° |
HAE | CAE | CAG | CAR | 179.1° | 179.9° |
HAE | CAE | CAG | HAG | 1.0° | 0.2° |
CAF | CAQ | OAM | CAT | 178.7° | 179.8° |
CAF | CAQ | OAM | CAP | 145.4° | 148.1° |
CAF | CAQ | CAT | CAR | 1.9° | 0.6° |
CAF | CAQ | CAT | CAU | 179.4° | 178.7° |
HAF | CAF | CAQ | OAM | 1.0° | 0.3° |
HAF | CAF | CAQ | CAT | 177.7° | 179.9° |
CAG | CAR | CAN | CAT | 177.7° | 179.8° |
CAG | CAR | CAT | CAQ | 0.0° | 0.6° |
CAG | CAR | CAT | CAU | 178.8° | 178.6° |
HAG | CAG | CAR | CAN | 0.9° | 0.5° |
HAG | CAG | CAR | CAT | 178.6° | 179.8° |
CAI | CAH | CAO | HAH | 180.0° | 180.0° |
CAH | CAI | CAP | HAI | 180.0° | 180.0° |
CAI | CAH | CAO | CAJ | 0.3° | 0.1° |
CAH | CAI | CAP | OAM | 178.9° | 179.2° |
CAI | CAH | CAO | SAV | 179.2° | 180.0° |
CAH | CAI | CAP | CAS | 0.8° | 0.2° |
CAO | CAH | CAI | CAP | 0.5° | 0.0° |
CAO | CAH | CAI | HAI | 179.5° | 180.0° |
CAH | CAO | CAJ | CAS | 0.7° | 0.0° |
CAH | CAO | CAJ | SAV | 179.5° | 179.9° |
CAH | CAO | CAJ | HAJ | 179.3° | 179.9° |
HAH | CAH | CAI | CAP | 179.5° | 180.0° |
HAH | CAH | CAI | HAI | 0.5° | 0.0° |
HAH | CAH | CAO | CAJ | 179.7° | 179.9° |
HAH | CAH | CAO | SAV | 0.8° | 0.0° |
CAI | CAP | CAS | CAJ | 0.3° | 0.2° |
CAI | CAP | OAM | CAQ | 146.0° | 149.3° |
CAI | CAP | OAM | CAS | 179.7° | 179.1° |
CAI | CAP | CAS | CAU | 179.4° | 179.7° |
HAI | CAI | CAP | OAM | 1.1° | 0.8° |
HAI | CAI | CAP | CAS | 179.2° | 179.9° |
CAS | CAJ | CAO | HAJ | 180.0° | 179.9° |
CAJ | CAS | CAU | CAK | 28.3° | 34.8° |
CAJ | CAS | CAP | OAM | 179.4° | 179.3° |
CAS | CAJ | CAO | SAV | 178.7° | 179.9° |
CAJ | CAS | CAP | CAU | 179.7° | 179.9° |
CAJ | CAS | CAU | CAT | 148.9° | 153.9° |
CAJ | CAS | CAU | HAU | 90.4° | 86.1° |
CAO | CAJ | CAS | CAP | 0.4° | 0.2° |
CAO | CAJ | CAS | CAU | 179.9° | 179.8° |
HAJ | CAJ | CAO | SAV | 1.3° | 0.0° |
HAJ | CAJ | CAS | CAP | 179.6° | 179.9° |
HAJ | CAJ | CAS | CAU | 0.1° | 0.2° |
CAU | CAK | HAK | HAKA | 119.2° | 119.3° |
CAK | CAU | CAS | CAP | 152.1° | 145.3° |
CAK | CAU | CAT | CAQ | 152.8° | 144.8° |
CAK | CAU | CAT | CAR | 28.4° | 34.4° |
CAK | CAU | CAS | CAT | 120.7° | 119.1° |
CAK | CAU | CAS | HAU | 118.7° | 120.8° |
CAK | CAU | CAT | HAU | 118.7° | 120.2° |
HAK | CAK | CAU | CAS | 43.4° | 50.7° |
HAK | CAK | CAU | CAT | 76.3° | 67.9° |
HAK | CAK | CAU | HAU | 163.0° | 172.1° |
HAKA | CAK | CAU | CAS | 76.6° | 68.6° |
HAKA | CAK | CAU | CAT | 163.7° | 172.8° |
HAKA | CAK | CAU | HAU | 43.0° | 52.8° |
CAQ | OAM | CAP | CAS | 33.7° | 31.6° |
OAM | CAQ | CAT | CAR | 179.4° | 179.2° |
OAM | CAQ | CAT | CAU | 0.6° | 1.5° |
CAP | OAM | CAQ | CAT | 33.3° | 32.1° |
OAM | CAP | CAS | CAU | 1.0° | 0.6° |
CAN | CAR | CAT | CAQ | 177.7° | 179.1° |
CAN | CAR | CAT | CAU | 1.1° | 1.6° |
CAP | CAS | CAU | CAT | 31.4° | 26.2° |
CAP | CAS | CAU | HAU | 89.3° | 93.9° |
CAQ | CAT | CAR | CAU | 178.7° | 179.3° |
CAQ | CAT | CAU | CAS | 31.2° | 25.8° |
CAQ | CAT | CAU | HAU | 88.5° | 95.0° |
CAR | CAT | CAU | CAS | 150.1° | 153.4° |
CAR | CAT | CAU | HAU | 90.3° | 85.7° |
CAS | CAU | CAT | HAU | 119.7° | 120.8° |