GFU
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAY | OAC | sing | 1.43Å | 1.45Å | |
| OAC | CAS | sing | 1.36Å | 1.37Å | |
| CAS | CAO | doub | 1.38Å | 1.40Å | Aromatic |
| CAS | CAU | sing | 1.39Å | 1.39Å | Aromatic |
| CAO | CAM | sing | 1.38Å | 1.40Å | Aromatic |
| CAU | OAE | sing | 1.36Å | 1.37Å | |
| CAU | CAT | doub | 1.38Å | 1.40Å | Aromatic |
| CAT | CAP | sing | 1.38Å | 1.39Å | Aromatic |
| CAP | CAM | doub | 1.38Å | 1.38Å | Aromatic |
| CAM | CAI | sing | 1.51Å | 1.43Å | |
| CAI | CAG | sing | 1.54Å | 1.47Å | |
| CAI | OAA | sing | 1.44Å | 1.51Å | |
| CAG | CAL | sing | 1.53Å | 1.51Å | |
| CAG | CAH | sing | 1.55Å | 1.51Å | |
| CAL | OAB | sing | 1.43Å | 1.42Å | |
| OAA | CAJ | sing | 1.44Å | 1.41Å | |
| CAJ | CAH | sing | 1.55Å | 1.61Å | |
| CAH | CAK | sing | 1.53Å | 1.52Å | |
| CAK | CAN | sing | 1.51Å | 1.38Å | |
| CAN | CAQ | doub | 1.38Å | 1.38Å | Aromatic |
| CAN | CAR | sing | 1.38Å | 1.40Å | Aromatic |
| CAQ | CAV | sing | 1.39Å | 1.38Å | Aromatic |
| CAR | CAW | doub | 1.38Å | 1.40Å | Aromatic |
| CAW | CAX | sing | 1.39Å | 1.39Å | Aromatic |
| CAX | OAF | sing | 1.36Å | 1.35Å | |
| CAX | CAV | doub | 1.39Å | 1.40Å | Aromatic |
| CAV | OAD | sing | 1.36Å | 1.36Å | |
| OAD | CAZ | sing | 1.43Å | 1.44Å | |
| CAY | H1 | sing | 1.09Å | 1.10Å | |
| CAY | H2 | sing | 1.09Å | 1.10Å | |
| CAY | H3 | sing | 1.09Å | 1.10Å | |
| CAO | H4 | sing | 1.08Å | 1.08Å | |
| OAE | H5 | sing | 0.97Å | 0.95Å | |
| CAT | H6 | sing | 1.08Å | 1.08Å | |
| CAP | H7 | sing | 1.08Å | 1.08Å | |
| CAI | H8 | sing | 1.09Å | 1.10Å | |
| CAG | H9 | sing | 1.09Å | 1.10Å | |
| CAL | H10 | sing | 1.09Å | 1.10Å | |
| CAL | H11 | sing | 1.09Å | 1.10Å | |
| OAB | H12 | sing | 0.97Å | 0.95Å | |
| CAJ | H13 | sing | 1.09Å | 1.10Å | |
| CAJ | H14 | sing | 1.09Å | 1.10Å | |
| CAH | H15 | sing | 1.09Å | 1.10Å | |
| CAK | H16 | sing | 1.09Å | 1.10Å | |
| CAK | H17 | sing | 1.09Å | 1.10Å | |
| CAQ | H18 | sing | 1.08Å | 1.08Å | |
| CAR | H19 | sing | 1.08Å | 1.08Å | |
| CAW | H20 | sing | 1.08Å | 1.08Å | |
| OAF | H21 | sing | 0.97Å | 0.95Å | |
| CAZ | H22 | sing | 1.09Å | 1.10Å | |
| CAZ | H23 | sing | 1.09Å | 1.10Å | |
| CAZ | H24 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAY | OAC | CAS | 116.1° | 117.0° |
| OAC | CAY | H1 | 109.5° | 109.5° |
| OAC | CAY | H2 | 109.5° | 109.5° |
| OAC | CAY | H3 | 109.4° | 109.5° |
| OAC | CAS | CAO | 125.1° | 120.1° |
| OAC | CAS | CAU | 116.6° | 120.1° |
| CAO | CAS | CAU | 118.2° | 119.9° |
| CAS | CAO | CAM | 121.9° | 120.0° |
| CAS | CAO | H4 | 119.0° | 120.0° |
| CAS | CAU | OAE | 117.5° | 120.0° |
| CAS | CAU | CAT | 120.3° | 119.8° |
| CAO | CAM | CAP | 118.9° | 120.1° |
| CAO | CAM | CAI | 117.9° | 120.0° |
| CAM | CAO | H4 | 119.1° | 120.0° |
| OAE | CAU | CAT | 122.2° | 120.1° |
| CAU | OAE | H5 | 109.5° | 114.0° |
| CAU | CAT | CAP | 120.6° | 120.1° |
| CAU | CAT | H6 | 119.7° | 120.0° |
| CAT | CAP | CAM | 120.1° | 120.1° |
| CAP | CAT | H6 | 119.7° | 119.9° |
| CAT | CAP | H7 | 119.9° | 120.0° |
| CAP | CAM | CAI | 123.2° | 119.9° |
| CAM | CAP | H7 | 119.9° | 119.9° |
| CAM | CAI | CAG | 109.8° | 110.4° |
| CAM | CAI | OAA | 123.2° | 110.4° |
| CAM | CAI | H8 | 108.1° | 110.3° |
| CAG | CAI | OAA | 100.0° | 104.8° |
| CAI | CAG | CAL | 116.1° | 110.5° |
| CAI | CAG | CAH | 110.3° | 104.0° |
| CAG | CAI | H8 | 107.5° | 110.3° |
| CAI | CAG | H9 | 109.2° | 110.5° |
| CAI | OAA | CAJ | 82.3° | 105.3° |
| OAA | CAI | H8 | 107.1° | 110.5° |
| CAL | CAG | CAH | 103.4° | 110.5° |
| CAG | CAL | OAB | 104.2° | 109.5° |
| CAL | CAG | H9 | 108.8° | 110.5° |
| CAG | CAL | H10 | 110.8° | 109.5° |
| CAG | CAL | H11 | 110.8° | 109.5° |
| CAG | CAH | CAJ | 85.4° | 104.1° |
| CAG | CAH | CAK | 138.7° | 110.5° |
| CAH | CAG | H9 | 108.7° | 110.7° |
| CAG | CAH | H15 | 110.7° | 110.5° |
| OAB | CAL | H10 | 110.8° | 109.5° |
| OAB | CAL | H11 | 110.8° | 109.4° |
| CAL | OAB | H12 | 109.5° | 114.0° |
| OAA | CAJ | CAH | 115.4° | 104.8° |
| OAA | CAJ | H13 | 108.0° | 110.4° |
| OAA | CAJ | H14 | 108.0° | 110.4° |
| CAJ | CAH | CAK | 80.8° | 110.5° |
| CAH | CAJ | H13 | 108.0° | 110.3° |
| CAH | CAJ | H14 | 108.0° | 110.4° |
| CAJ | CAH | H15 | 109.4° | 110.5° |
| CAH | CAK | CAN | 114.2° | 109.5° |
| CAK | CAH | H15 | 110.5° | 110.5° |
| CAH | CAK | H16 | 108.3° | 109.5° |
| CAH | CAK | H17 | 108.3° | 109.4° |
| CAK | CAN | CAQ | 115.3° | 119.9° |
| CAK | CAN | CAR | 123.6° | 120.0° |
| CAN | CAK | H16 | 108.3° | 109.5° |
| CAN | CAK | H17 | 108.3° | 109.5° |
| CAQ | CAN | CAR | 121.0° | 120.1° |
| CAN | CAQ | CAV | 119.3° | 120.0° |
| CAN | CAQ | H18 | 120.4° | 120.0° |
| CAN | CAR | CAW | 119.8° | 120.2° |
| CAN | CAR | H19 | 120.1° | 119.9° |
| CAQ | CAV | CAX | 120.4° | 119.9° |
| CAQ | CAV | OAD | 120.9° | 120.1° |
| CAV | CAQ | H18 | 120.4° | 120.0° |
| CAR | CAW | CAX | 118.7° | 120.0° |
| CAW | CAR | H19 | 120.1° | 119.9° |
| CAR | CAW | H20 | 120.6° | 120.0° |
| CAW | CAX | OAF | 123.0° | 120.1° |
| CAW | CAX | CAV | 120.8° | 119.8° |
| CAX | CAW | H20 | 120.7° | 120.0° |
| OAF | CAX | CAV | 116.2° | 120.1° |
| CAX | OAF | H21 | 109.5° | 114.0° |
| CAX | CAV | OAD | 118.7° | 120.1° |
| CAV | OAD | CAZ | 110.7° | 117.0° |
| OAD | CAZ | H22 | 109.5° | 109.5° |
| OAD | CAZ | H23 | 109.5° | 109.5° |
| OAD | CAZ | H24 | 109.5° | 109.5° |
| H1 | CAY | H2 | 109.5° | 109.5° |
| H1 | CAY | H3 | 109.5° | 109.4° |
| H2 | CAY | H3 | 109.4° | 109.4° |
| H10 | CAL | H11 | 109.5° | 109.5° |
| H13 | CAJ | H14 | 109.4° | 110.5° |
| H16 | CAK | H17 | 109.5° | 109.5° |
| H22 | CAZ | H23 | 109.5° | 109.4° |
| H22 | CAZ | H24 | 109.4° | 109.5° |
| H23 | CAZ | H24 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAY | OAC | CAS | CAO | 1.6° | 0.0° |
| CAY | OAC | CAS | CAU | 179.0° | 179.7° |
| OAC | CAY | H1 | H2 | 120.0° | 120.0° |
| OAC | CAY | H1 | H3 | 120.0° | 120.0° |
| OAC | CAY | H2 | H3 | 119.9° | 120.0° |
| OAC | CAS | CAO | CAU | 179.4° | 179.7° |
| OAC | CAS | CAO | CAM | 179.4° | 180.0° |
| OAC | CAS | CAU | OAE | 0.3° | 0.1° |
| OAC | CAS | CAU | CAT | 179.3° | 180.0° |
| CAS | OAC | CAY | H1 | 180.0° | 180.0° |
| CAS | OAC | CAY | H2 | 60.0° | 60.0° |
| CAS | OAC | CAY | H3 | 60.0° | 60.0° |
| OAC | CAS | CAO | H4 | 0.6° | 0.0° |
| CAS | CAO | CAM | H4 | 180.0° | 180.0° |
| CAO | CAS | CAU | OAE | 179.1° | 179.7° |
| CAO | CAS | CAU | CAT | 0.2° | 0.3° |
| CAS | CAO | CAM | CAP | 0.7° | 0.0° |
| CAS | CAO | CAM | CAI | 179.0° | 180.0° |
| CAU | CAS | CAO | CAM | 0.1° | 0.3° |
| CAS | CAU | OAE | CAT | 178.9° | 180.0° |
| CAS | CAU | CAT | CAP | 1.0° | 0.0° |
| CAU | CAS | CAO | H4 | 179.9° | 179.7° |
| CAS | CAU | OAE | H5 | 180.0° | 90.0° |
| CAS | CAU | CAT | H6 | 179.0° | 180.0° |
| CAO | CAM | CAP | CAT | 1.4° | 0.3° |
| CAO | CAM | CAP | CAI | 178.2° | 180.0° |
| CAO | CAM | CAI | CAG | 115.9° | 94.9° |
| CAO | CAM | CAI | OAA | 126.9° | 149.6° |
| CAO | CAM | CAP | H7 | 178.6° | 180.0° |
| CAO | CAM | CAI | H8 | 1.1° | 27.2° |
| OAE | CAU | CAT | CAP | 179.9° | 180.0° |
| OAE | CAU | CAT | H6 | 0.2° | 0.0° |
| CAU | CAT | CAP | H6 | 180.0° | 180.0° |
| CAU | CAT | CAP | CAM | 1.6° | 0.3° |
| CAT | CAU | OAE | H5 | 1.1° | 90.0° |
| CAU | CAT | CAP | H7 | 178.4° | 180.0° |
| CAT | CAP | CAM | H7 | 180.0° | 179.7° |
| CAT | CAP | CAM | CAI | 179.6° | 179.7° |
| CAP | CAM | CAI | CAG | 65.8° | 85.0° |
| CAP | CAM | CAI | OAA | 51.3° | 30.4° |
| CAP | CAM | CAO | H4 | 179.4° | 180.0° |
| CAM | CAP | CAT | H6 | 178.4° | 179.7° |
| CAP | CAM | CAI | H8 | 177.1° | 152.8° |
| CAM | CAI | CAG | OAA | 130.9° | 118.9° |
| CAM | CAI | CAG | H8 | 117.4° | 122.2° |
| CAM | CAI | OAA | H8 | 126.3° | 122.3° |
| CAM | CAI | CAG | CAL | 63.2° | 98.5° |
| CAM | CAI | CAG | CAH | 179.6° | 142.9° |
| CAM | CAI | OAA | CAJ | 178.6° | 159.4° |
| CAI | CAM | CAO | H4 | 1.0° | 0.0° |
| CAI | CAM | CAP | H7 | 0.4° | 0.0° |
| CAM | CAI | CAG | H9 | 60.2° | 24.1° |
| CAG | CAI | OAA | H8 | 112.0° | 118.9° |
| CAI | CAG | CAL | CAH | 120.9° | 114.6° |
| CAI | CAG | CAL | H9 | 123.6° | 122.6° |
| CAI | CAG | CAH | H9 | 119.7° | 118.7° |
| CAI | CAG | CAL | OAB | 179.9° | 66.5° |
| CAG | CAI | OAA | CAJ | 59.6° | 40.5° |
| CAI | CAG | CAH | CAJ | 9.8° | 0.0° |
| CAI | CAG | CAH | CAK | 60.6° | 118.7° |
| CAI | CAG | CAL | H10 | 60.7° | 53.5° |
| CAI | CAG | CAL | H11 | 60.9° | 173.6° |
| CAI | CAG | CAH | H15 | 118.8° | 118.6° |
| OAA | CAI | CAG | CAL | 165.9° | 142.6° |
| OAA | CAI | CAG | CAH | 48.7° | 24.0° |
| CAI | OAA | CAJ | CAH | 63.1° | 40.5° |
| OAA | CAI | CAG | H9 | 70.7° | 94.8° |
| CAI | OAA | CAJ | H13 | 57.8° | 78.3° |
| CAI | OAA | CAJ | H14 | 176.0° | 159.3° |
| CAL | CAG | CAH | H9 | 115.5° | 122.7° |
| CAG | CAL | OAB | H10 | 119.2° | 120.1° |
| CAG | CAL | OAB | H11 | 119.2° | 120.0° |
| CAL | CAG | CAH | CAJ | 134.6° | 118.6° |
| CAL | CAG | CAH | CAK | 64.2° | 0.1° |
| CAL | CAG | CAI | H8 | 54.2° | 23.6° |
| CAG | CAL | H10 | H11 | 122.5° | 120.0° |
| CAG | CAL | OAB | H12 | 180.0° | 180.0° |
| CAL | CAG | CAH | H15 | 116.4° | 122.7° |
| CAH | CAG | CAL | OAB | 59.2° | 178.9° |
| CAG | CAH | CAJ | OAA | 36.9° | 24.0° |
| CAG | CAH | CAJ | CAK | 141.0° | 118.7° |
| CAG | CAH | CAJ | H15 | 110.4° | 118.6° |
| CAG | CAH | CAK | H15 | 179.4° | 122.7° |
| CAG | CAH | CAK | CAN | 132.5° | 175.0° |
| CAH | CAG | CAI | H8 | 62.9° | 95.0° |
| CAH | CAG | CAL | H10 | 178.3° | 61.1° |
| CAH | CAG | CAL | H11 | 60.0° | 59.0° |
| CAG | CAH | CAJ | H13 | 83.9° | 94.8° |
| CAG | CAH | CAJ | H14 | 157.8° | 142.8° |
| CAG | CAH | CAK | H16 | 11.8° | 55.0° |
| CAG | CAH | CAK | H17 | 106.8° | 65.1° |
| OAB | CAL | CAG | H9 | 56.3° | 56.1° |
| OAB | CAL | H10 | H11 | 122.4° | 119.9° |
| OAA | CAJ | CAH | H13 | 120.9° | 118.8° |
| OAA | CAJ | CAH | H14 | 120.9° | 118.8° |
| OAA | CAJ | CAH | CAK | 177.9° | 142.6° |
| CAJ | OAA | CAI | H8 | 52.4° | 78.4° |
| OAA | CAJ | H13 | H14 | 117.3° | 122.3° |
| OAA | CAJ | CAH | H15 | 73.5° | 94.7° |
| CAJ | CAH | CAK | H15 | 107.3° | 122.7° |
| CAJ | CAH | CAK | CAN | 155.4° | 70.3° |
| CAJ | CAH | CAG | H9 | 109.9° | 118.7° |
| CAH | CAJ | H13 | H14 | 117.3° | 122.3° |
| CAJ | CAH | CAK | H16 | 83.9° | 169.6° |
| CAJ | CAH | CAK | H17 | 34.7° | 49.6° |
| CAH | CAK | CAN | H16 | 120.7° | 120.0° |
| CAH | CAK | CAN | H17 | 120.7° | 119.9° |
| CAH | CAK | CAN | CAQ | 177.5° | 90.1° |
| CAH | CAK | CAN | CAR | 2.6° | 90.3° |
| CAK | CAH | CAG | H9 | 179.7° | 122.6° |
| CAK | CAH | CAJ | H13 | 57.0° | 23.9° |
| CAK | CAH | CAJ | H14 | 61.2° | 98.5° |
| CAH | CAK | H16 | H17 | 117.9° | 120.0° |
| CAK | CAN | CAQ | CAR | 175.1° | 179.7° |
| CAK | CAN | CAQ | CAV | 177.1° | 180.0° |
| CAK | CAN | CAR | CAW | 177.6° | 180.0° |
| CAN | CAK | CAH | H15 | 48.1° | 52.3° |
| CAN | CAK | H16 | H17 | 117.9° | 120.0° |
| CAK | CAN | CAQ | H18 | 2.9° | 0.1° |
| CAK | CAN | CAR | H19 | 2.4° | 0.0° |
| CAN | CAQ | CAV | H18 | 180.0° | 179.9° |
| CAQ | CAN | CAR | CAW | 3.0° | 0.3° |
| CAN | CAQ | CAV | CAX | 0.1° | 0.1° |
| CAN | CAQ | CAV | OAD | 177.7° | 180.0° |
| CAQ | CAN | CAK | H16 | 56.8° | 30.0° |
| CAQ | CAN | CAK | H17 | 61.8° | 150.0° |
| CAQ | CAN | CAR | H19 | 177.0° | 179.7° |
| CAR | CAN | CAQ | CAV | 2.0° | 0.3° |
| CAN | CAR | CAW | H19 | 180.0° | 180.0° |
| CAN | CAR | CAW | CAX | 1.8° | 0.0° |
| CAR | CAN | CAK | H16 | 118.1° | 149.7° |
| CAR | CAN | CAK | H17 | 123.3° | 29.6° |
| CAR | CAN | CAQ | H18 | 178.0° | 179.8° |
| CAN | CAR | CAW | H20 | 178.3° | 180.0° |
| CAQ | CAV | CAX | CAW | 1.3° | 0.2° |
| CAQ | CAV | CAX | OAF | 178.3° | 180.0° |
| CAQ | CAV | CAX | OAD | 177.6° | 179.9° |
| CAQ | CAV | OAD | CAZ | 0.1° | 0.1° |
| CAR | CAW | CAX | H20 | 180.0° | 180.0° |
| CAR | CAW | CAX | OAF | 179.2° | 180.0° |
| CAR | CAW | CAX | CAV | 0.4° | 0.2° |
| CAW | CAX | OAF | CAV | 179.6° | 179.8° |
| CAW | CAX | CAV | OAD | 178.9° | 179.7° |
| CAX | CAW | CAR | H19 | 178.3° | 180.0° |
| CAW | CAX | OAF | H21 | 180.0° | 90.0° |
| OAF | CAX | CAV | OAD | 0.6° | 0.0° |
| OAF | CAX | CAW | H20 | 0.8° | 0.0° |
| CAX | CAV | OAD | CAZ | 177.5° | 180.0° |
| CAX | CAV | CAQ | H18 | 179.9° | 180.0° |
| CAV | CAX | CAW | H20 | 179.6° | 179.7° |
| CAV | CAX | OAF | H21 | 0.4° | 90.2° |
| OAD | CAV | CAQ | H18 | 2.3° | 0.1° |
| CAV | OAD | CAZ | H22 | 180.0° | 60.0° |
| CAV | OAD | CAZ | H23 | 60.0° | 60.0° |
| CAV | OAD | CAZ | H24 | 60.0° | 180.0° |
| OAD | CAZ | H22 | H23 | 120.0° | 120.0° |
| OAD | CAZ | H22 | H24 | 120.0° | 120.0° |
| OAD | CAZ | H23 | H24 | 120.0° | 120.0° |
| H1 | CAY | H2 | H3 | 120.0° | 119.9° |
| H6 | CAT | CAP | H7 | 1.6° | 0.0° |
| H8 | CAI | CAG | H9 | 177.6° | 146.2° |
| H9 | CAG | CAL | H10 | 62.9° | 176.1° |
| H9 | CAG | CAL | H11 | 175.4° | 63.8° |
| H9 | CAG | CAH | H15 | 1.0° | 0.1° |
| H10 | CAL | OAB | H12 | 60.8° | 59.9° |
| H11 | CAL | OAB | H12 | 60.8° | 60.0° |
| H13 | CAJ | CAH | H15 | 165.7° | 146.5° |
| H14 | CAJ | CAH | H15 | 47.4° | 24.2° |
| H15 | CAH | CAK | H16 | 168.8° | 67.7° |
| H15 | CAH | CAK | H17 | 72.6° | 172.3° |
| H19 | CAR | CAW | H20 | 1.7° | 0.0° |
| H22 | CAZ | H23 | H24 | 119.9° | 120.0° |
