7FY
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
OAA | CAR | doub | 1.21Å | 1.23Å | |
OAD | CAW | doub | 1.21Å | 1.20Å | |
CAR | CAW | sing | 1.50Å | 1.37Å | |
CAR | CAE | sing | 1.52Å | 1.40Å | |
CAW | CAG | sing | 1.52Å | 1.40Å | |
CAE | CAF | sing | 1.50Å | 1.40Å | |
CAG | CAS | sing | 1.50Å | 1.40Å | |
CAF | CAS | doub | 1.30Å | 1.38Å | |
CAS | NAQ | sing | 1.39Å | 1.45Å | |
NAQ | SAX | sing | 1.66Å | 1.65Å | |
OAB | SAX | doub | 1.42Å | 1.51Å | |
SAX | CAV | sing | 1.76Å | 1.82Å | |
SAX | OAC | doub | 1.42Å | 1.52Å | |
CAP | CAV | doub | 1.38Å | 1.40Å | Aromatic |
CAP | CAN | sing | 1.38Å | 1.39Å | Aromatic |
CAV | CAO | sing | 1.38Å | 1.40Å | Aromatic |
CAN | CAU | doub | 1.39Å | 1.40Å | Aromatic |
CAO | CAM | doub | 1.38Å | 1.42Å | Aromatic |
CAU | CAM | sing | 1.39Å | 1.39Å | Aromatic |
CAU | CAT | sing | 1.48Å | 1.53Å | |
CAT | CAL | doub | 1.39Å | 1.38Å | Aromatic |
CAT | CAK | sing | 1.39Å | 1.40Å | Aromatic |
CAL | CAJ | sing | 1.38Å | 1.40Å | Aromatic |
CAK | CAI | doub | 1.38Å | 1.39Å | Aromatic |
CAJ | CAH | doub | 1.38Å | 1.40Å | Aromatic |
CAI | CAH | sing | 1.38Å | 1.38Å | Aromatic |
CAG | H1 | sing | 1.09Å | 1.10Å | |
CAG | H2 | sing | 1.09Å | 1.10Å | |
CAE | H3 | sing | 1.09Å | 1.10Å | |
CAE | H4 | sing | 1.09Å | 1.10Å | |
CAF | H5 | sing | 1.08Å | 1.08Å | |
NAQ | H6 | sing | 0.97Å | 1.00Å | |
CAP | H7 | sing | 1.08Å | 1.08Å | |
CAN | H8 | sing | 1.08Å | 1.08Å | |
CAO | H9 | sing | 1.08Å | 1.08Å | |
CAM | H10 | sing | 1.08Å | 1.08Å | |
CAK | H11 | sing | 1.08Å | 1.08Å | |
CAI | H12 | sing | 1.08Å | 1.08Å | |
CAH | H13 | sing | 1.08Å | 1.08Å | |
CAJ | H14 | sing | 1.08Å | 1.08Å | |
CAL | H15 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
OAA | CAR | CAW | 122.9° | 122.2° |
OAA | CAR | CAE | 119.5° | 122.3° |
OAD | CAW | CAR | 121.0° | 122.3° |
OAD | CAW | CAG | 116.5° | 122.2° |
CAW | CAR | CAE | 117.6° | 115.5° |
CAR | CAW | CAG | 122.5° | 115.5° |
CAR | CAE | CAF | 121.2° | 109.3° |
CAR | CAE | H3 | 106.5° | 109.5° |
CAR | CAE | H4 | 106.5° | 109.5° |
CAW | CAG | CAS | 119.0° | 109.4° |
CAW | CAG | H1 | 107.0° | 109.5° |
CAW | CAG | H2 | 107.1° | 109.5° |
CAE | CAF | CAS | 120.2° | 125.9° |
CAF | CAE | H3 | 106.5° | 109.5° |
CAF | CAE | H4 | 106.5° | 109.5° |
CAE | CAF | H5 | 119.9° | 117.0° |
CAG | CAS | CAF | 119.5° | 125.8° |
CAG | CAS | NAQ | 120.7° | 117.1° |
CAS | CAG | H1 | 107.1° | 109.5° |
CAS | CAG | H2 | 107.0° | 109.5° |
CAF | CAS | NAQ | 119.8° | 117.1° |
CAS | CAF | H5 | 119.9° | 117.1° |
CAS | NAQ | SAX | 123.2° | 120.0° |
CAS | NAQ | H6 | 105.9° | 120.0° |
NAQ | SAX | OAB | 112.0° | 106.4° |
NAQ | SAX | CAV | 107.6° | 107.2° |
NAQ | SAX | OAC | 109.3° | 106.4° |
SAX | NAQ | H6 | 105.9° | 120.0° |
OAB | SAX | CAV | 109.9° | 106.4° |
OAB | SAX | OAC | 108.8° | 123.1° |
CAV | SAX | OAC | 109.3° | 106.4° |
SAX | CAV | CAP | 118.1° | 119.9° |
SAX | CAV | CAO | 121.7° | 119.9° |
CAV | CAP | CAN | 119.9° | 120.1° |
CAP | CAV | CAO | 120.1° | 120.2° |
CAV | CAP | H7 | 120.0° | 119.9° |
CAP | CAN | CAU | 120.6° | 119.9° |
CAN | CAP | H7 | 120.0° | 120.0° |
CAP | CAN | H8 | 119.7° | 120.0° |
CAV | CAO | CAM | 119.7° | 120.1° |
CAV | CAO | H9 | 120.1° | 119.9° |
CAN | CAU | CAM | 119.7° | 119.7° |
CAN | CAU | CAT | 118.1° | 120.1° |
CAU | CAN | H8 | 119.7° | 120.1° |
CAO | CAM | CAU | 119.9° | 119.9° |
CAM | CAO | H9 | 120.1° | 120.0° |
CAO | CAM | H10 | 120.1° | 120.0° |
CAM | CAU | CAT | 122.1° | 120.2° |
CAU | CAM | H10 | 120.1° | 120.0° |
CAU | CAT | CAL | 121.7° | 120.1° |
CAU | CAT | CAK | 119.2° | 120.1° |
CAL | CAT | CAK | 119.1° | 119.8° |
CAT | CAL | CAJ | 119.2° | 119.9° |
CAT | CAL | H15 | 120.4° | 120.1° |
CAT | CAK | CAI | 121.8° | 119.9° |
CAT | CAK | H11 | 119.1° | 120.0° |
CAL | CAJ | CAH | 121.6° | 120.1° |
CAL | CAJ | H14 | 119.2° | 120.0° |
CAJ | CAL | H15 | 120.4° | 120.1° |
CAK | CAI | CAH | 119.1° | 120.2° |
CAI | CAK | H11 | 119.1° | 120.1° |
CAK | CAI | H12 | 120.4° | 119.9° |
CAJ | CAH | CAI | 119.2° | 120.2° |
CAJ | CAH | H13 | 120.4° | 119.8° |
CAH | CAJ | H14 | 119.2° | 119.9° |
CAH | CAI | H12 | 120.4° | 119.9° |
CAI | CAH | H13 | 120.4° | 119.9° |
H1 | CAG | H2 | 109.4° | 109.5° |
H3 | CAE | H4 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
OAA | CAR | CAW | OAD | 0.3° | 52.3° |
OAA | CAR | CAW | CAE | 179.8° | 180.0° |
OAA | CAR | CAW | CAG | 179.8° | 127.7° |
OAA | CAR | CAE | CAF | 179.5° | 143.0° |
OAA | CAR | CAE | H3 | 58.9° | 23.0° |
OAA | CAR | CAE | H4 | 57.9° | 97.0° |
OAD | CAW | CAR | CAG | 179.5° | 180.0° |
OAD | CAW | CAR | CAE | 179.9° | 127.7° |
OAD | CAW | CAG | CAS | 179.8° | 143.0° |
OAD | CAW | CAG | H1 | 58.5° | 23.0° |
OAD | CAW | CAG | H2 | 58.8° | 97.1° |
CAW | CAR | CAE | CAF | 0.7° | 37.0° |
CAR | CAW | CAG | CAS | 0.3° | 37.0° |
CAR | CAW | CAG | H1 | 121.0° | 157.0° |
CAR | CAW | CAG | H2 | 121.7° | 82.9° |
CAW | CAR | CAE | H3 | 121.0° | 157.0° |
CAW | CAR | CAE | H4 | 122.3° | 82.9° |
CAE | CAR | CAW | CAG | 0.3° | 52.3° |
CAR | CAE | CAF | H3 | 121.6° | 120.0° |
CAR | CAE | CAF | H4 | 121.6° | 120.0° |
CAR | CAE | CAF | CAS | 1.0° | 13.0° |
CAR | CAE | H3 | H4 | 114.7° | 120.0° |
CAR | CAE | CAF | H5 | 179.0° | 167.0° |
CAW | CAG | CAS | H1 | 121.4° | 120.0° |
CAW | CAG | CAS | H2 | 121.4° | 120.0° |
CAW | CAG | CAS | CAF | 0.6° | 12.9° |
CAW | CAG | CAS | NAQ | 179.8° | 167.0° |
CAW | CAG | H1 | H2 | 115.7° | 120.1° |
CAE | CAF | CAS | CAG | 1.0° | 1.5° |
CAE | CAF | CAS | H5 | 180.0° | 180.0° |
CAE | CAF | CAS | NAQ | 179.9° | 178.5° |
CAF | CAE | H3 | H4 | 114.7° | 120.1° |
CAG | CAS | CAF | NAQ | 179.2° | 179.9° |
CAG | CAS | NAQ | SAX | 117.6° | 179.9° |
CAS | CAG | H1 | H2 | 115.7° | 120.0° |
CAG | CAS | CAF | H5 | 179.0° | 178.5° |
CAG | CAS | NAQ | H6 | 120.5° | 0.0° |
CAF | CAS | NAQ | SAX | 63.2° | 0.2° |
CAF | CAS | CAG | H1 | 120.7° | 132.9° |
CAF | CAS | CAG | H2 | 122.0° | 107.1° |
CAS | CAF | CAE | H3 | 120.6° | 132.9° |
CAS | CAF | CAE | H4 | 122.6° | 107.0° |
CAF | CAS | NAQ | H6 | 58.7° | 179.9° |
CAS | NAQ | SAX | H6 | 121.9° | 179.9° |
CAS | NAQ | SAX | OAB | 18.3° | 178.0° |
CAS | NAQ | SAX | CAV | 102.5° | 64.5° |
CAS | NAQ | SAX | OAC | 138.9° | 49.1° |
NAQ | CAS | CAG | H1 | 58.4° | 47.0° |
NAQ | CAS | CAG | H2 | 58.8° | 73.0° |
NAQ | CAS | CAF | H5 | 0.1° | 1.6° |
NAQ | SAX | OAB | CAV | 119.5° | 114.1° |
NAQ | SAX | OAB | OAC | 120.9° | 123.0° |
NAQ | SAX | CAV | OAC | 118.5° | 113.6° |
NAQ | SAX | CAV | CAP | 51.5° | 97.4° |
NAQ | SAX | CAV | CAO | 128.3° | 82.4° |
OAB | SAX | CAV | OAC | 119.3° | 132.9° |
OAB | SAX | CAV | CAP | 173.7° | 149.1° |
OAB | SAX | CAV | CAO | 6.1° | 31.2° |
OAB | SAX | NAQ | H6 | 103.6° | 2.1° |
SAX | CAV | CAP | CAO | 179.8° | 179.7° |
SAX | CAV | CAP | CAN | 179.8° | 180.0° |
SAX | CAV | CAO | CAM | 180.0° | 180.0° |
CAV | SAX | NAQ | H6 | 135.6° | 115.6° |
SAX | CAV | CAP | H7 | 0.2° | 0.0° |
SAX | CAV | CAO | H9 | 0.1° | 0.0° |
OAC | SAX | CAV | CAP | 67.0° | 16.2° |
OAC | SAX | CAV | CAO | 113.1° | 164.1° |
OAC | SAX | NAQ | H6 | 17.1° | 130.8° |
CAV | CAP | CAN | H7 | 180.0° | 180.0° |
CAV | CAP | CAN | CAU | 0.1° | 0.0° |
CAP | CAV | CAO | CAM | 0.2° | 0.3° |
CAV | CAP | CAN | H8 | 179.9° | 179.9° |
CAP | CAV | CAO | H9 | 179.8° | 179.7° |
CAN | CAP | CAV | CAO | 0.0° | 0.3° |
CAP | CAN | CAU | H8 | 180.0° | 179.9° |
CAP | CAN | CAU | CAM | 0.4° | 0.2° |
CAP | CAN | CAU | CAT | 179.3° | 180.0° |
CAV | CAO | CAM | H9 | 180.0° | 180.0° |
CAV | CAO | CAM | CAU | 0.5° | 0.0° |
CAO | CAV | CAP | H7 | 180.0° | 179.8° |
CAV | CAO | CAM | H10 | 179.5° | 180.0° |
CAN | CAU | CAM | CAO | 0.6° | 0.2° |
CAN | CAU | CAM | CAT | 178.8° | 179.8° |
CAN | CAU | CAT | CAL | 162.1° | 180.0° |
CAN | CAU | CAT | CAK | 18.5° | 0.3° |
CAU | CAN | CAP | H7 | 179.9° | 180.0° |
CAN | CAU | CAM | H10 | 179.4° | 179.8° |
CAO | CAM | CAU | H10 | 180.0° | 180.0° |
CAO | CAM | CAU | CAT | 179.4° | 180.0° |
CAM | CAU | CAT | CAL | 19.0° | 0.2° |
CAM | CAU | CAT | CAK | 160.4° | 179.5° |
CAM | CAU | CAN | H8 | 179.6° | 179.8° |
CAU | CAM | CAO | H9 | 179.5° | 180.0° |
CAU | CAT | CAL | CAK | 179.4° | 179.7° |
CAU | CAT | CAL | CAJ | 179.7° | 179.7° |
CAU | CAT | CAK | CAI | 179.1° | 180.0° |
CAT | CAU | CAN | H8 | 0.7° | 0.0° |
CAT | CAU | CAM | H10 | 0.6° | 0.0° |
CAU | CAT | CAK | H11 | 0.9° | 0.0° |
CAU | CAT | CAL | H15 | 0.4° | 0.0° |
CAT | CAL | CAJ | H15 | 180.0° | 179.7° |
CAL | CAT | CAK | CAI | 0.3° | 0.3° |
CAT | CAL | CAJ | CAH | 0.5° | 0.6° |
CAL | CAT | CAK | H11 | 179.7° | 179.7° |
CAT | CAL | CAJ | H14 | 179.5° | 179.7° |
CAK | CAT | CAL | CAJ | 0.3° | 0.6° |
CAT | CAK | CAI | H11 | 180.0° | 180.0° |
CAT | CAK | CAI | CAH | 0.7° | 0.0° |
CAT | CAK | CAI | H12 | 179.3° | 180.0° |
CAK | CAT | CAL | H15 | 179.7° | 179.7° |
CAL | CAJ | CAH | H14 | 180.0° | 179.7° |
CAL | CAJ | CAH | CAI | 0.2° | 0.3° |
CAL | CAJ | CAH | H13 | 179.8° | 179.7° |
CAK | CAI | CAH | CAJ | 0.4° | 0.0° |
CAK | CAI | CAH | H12 | 180.0° | 180.0° |
CAK | CAI | CAH | H13 | 179.6° | 179.9° |
CAJ | CAH | CAI | H13 | 180.0° | 180.0° |
CAJ | CAH | CAI | H12 | 179.6° | 180.0° |
CAH | CAJ | CAL | H15 | 179.5° | 179.7° |
CAH | CAI | CAK | H11 | 179.3° | 180.0° |
CAI | CAH | CAJ | H14 | 179.8° | 180.0° |
H3 | CAE | CAF | H5 | 59.4° | 47.0° |
H4 | CAE | CAF | H5 | 57.4° | 73.0° |
H7 | CAP | CAN | H8 | 0.1° | 0.0° |
H9 | CAO | CAM | H10 | 0.5° | 0.0° |
H11 | CAK | CAI | H12 | 0.7° | 0.0° |
H12 | CAI | CAH | H13 | 0.4° | 0.0° |
H13 | CAH | CAJ | H14 | 0.1° | 0.0° |
H14 | CAJ | CAL | H15 | 0.5° | 0.1° |