ZYM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAT | OAA | sing | 1.35Å | 1.25Å | |
| OAA | HOAA | sing | 0.97Å | 0.95Å | |
| OAB | CAU | doub | 1.21Å | 1.20Å | |
| OAC | CAT | doub | 1.21Å | 1.23Å | |
| OAD | CAV | doub | 1.21Å | 1.32Å | |
| CAU | CAE | sing | 1.51Å | 1.35Å | |
| CAV | CAE | sing | 1.51Å | 1.35Å | |
| CAE | HAE | sing | 1.09Å | 1.10Å | |
| CAE | HAEA | sing | 1.09Å | 1.10Å | |
| CAH | CAF | doub | 1.38Å | 1.36Å | Aromatic |
| CAG | CAF | sing | 1.38Å | 1.38Å | Aromatic |
| CAF | HAF | sing | 1.08Å | 1.08Å | |
| CAK | CAG | doub | 1.38Å | 1.37Å | Aromatic |
| CAG | HAG | sing | 1.08Å | 1.08Å | |
| CAL | CAH | sing | 1.38Å | 1.37Å | Aromatic |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAJ | CAI | doub | 1.38Å | 1.37Å | Aromatic |
| CAI | CAM | sing | 1.38Å | 1.37Å | Aromatic |
| CAI | HAI | sing | 1.08Å | 1.08Å | |
| CAW | CAJ | sing | 1.38Å | 1.37Å | Aromatic |
| CAJ | HAJ | sing | 1.08Å | 1.08Å | |
| CAX | CAK | sing | 1.39Å | 1.37Å | Aromatic |
| CAK | HAK | sing | 1.08Å | 1.08Å | |
| CAX | CAL | doub | 1.39Å | 1.37Å | Aromatic |
| CAL | HAL | sing | 1.08Å | 1.08Å | |
| CAY | CAM | doub | 1.39Å | 1.38Å | Aromatic |
| CAM | HAM | sing | 1.08Å | 1.08Å | |
| CAW | CAN | doub | 1.38Å | 1.37Å | Aromatic |
| CAN | CAY | sing | 1.39Å | 1.38Å | Aromatic |
| CAN | HAN | sing | 1.08Å | 1.08Å | |
| CAP | CAO | sing | 1.53Å | 1.52Å | |
| CAO | CAQ | sing | 1.53Å | 1.52Å | |
| CAO | HAO | sing | 1.09Å | 1.10Å | |
| CAO | HAOA | sing | 1.09Å | 1.10Å | |
| CAP | NAR | sing | 1.46Å | 1.46Å | |
| CAP | HAP | sing | 1.09Å | 1.10Å | |
| CAP | HAPA | sing | 1.09Å | 1.10Å | |
| CAQ | CAW | sing | 1.51Å | 1.50Å | |
| CAQ | HAQ | sing | 1.09Å | 1.10Å | |
| CAQ | HAQA | sing | 1.09Å | 1.10Å | |
| CAU | NAR | sing | 1.35Å | 1.32Å | |
| NAR | HNAR | sing | 0.97Å | 1.00Å | |
| CAY | OAS | sing | 1.36Å | 1.35Å | |
| OAS | CAX | sing | 1.36Å | 1.36Å | |
| CAV | CAT | sing | 1.49Å | 1.45Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAT | OAA | HOAA | 109.5° | 117.0° |
| OAA | CAT | OAC | 122.5° | 120.0° |
| OAA | CAT | CAV | 125.0° | 120.0° |
| OAB | CAU | CAE | 121.1° | 120.0° |
| OAB | CAU | NAR | 117.1° | 120.0° |
| OAC | CAT | CAV | 112.4° | 120.0° |
| OAD | CAV | CAE | 120.8° | 120.0° |
| OAD | CAV | CAT | 109.8° | 120.0° |
| CAU | CAE | CAV | 117.5° | 109.4° |
| CAU | CAE | HAE | 106.9° | 109.5° |
| CAU | CAE | HAEA | 106.9° | 109.5° |
| CAE | CAU | NAR | 121.7° | 120.0° |
| CAV | CAE | HAE | 106.9° | 109.5° |
| CAV | CAE | HAEA | 106.9° | 109.5° |
| CAE | CAV | CAT | 129.4° | 120.0° |
| HAE | CAE | HAEA | 111.9° | 109.5° |
| CAH | CAF | CAG | 119.5° | 120.1° |
| CAH | CAF | HAF | 120.3° | 119.9° |
| CAF | CAH | CAL | 119.3° | 120.0° |
| CAF | CAH | HAH | 120.3° | 120.0° |
| CAG | CAF | HAF | 120.2° | 119.9° |
| CAF | CAG | CAK | 120.7° | 120.1° |
| CAF | CAG | HAG | 119.6° | 120.0° |
| CAK | CAG | HAG | 119.6° | 120.0° |
| CAG | CAK | CAX | 120.1° | 119.9° |
| CAG | CAK | HAK | 120.0° | 120.1° |
| CAL | CAH | HAH | 120.3° | 120.0° |
| CAH | CAL | CAX | 121.9° | 120.0° |
| CAH | CAL | HAL | 119.0° | 120.0° |
| CAJ | CAI | CAM | 120.4° | 120.1° |
| CAJ | CAI | HAI | 119.8° | 119.9° |
| CAI | CAJ | CAW | 120.5° | 120.1° |
| CAI | CAJ | HAJ | 119.7° | 119.9° |
| CAM | CAI | HAI | 119.8° | 120.0° |
| CAI | CAM | CAY | 119.2° | 119.9° |
| CAI | CAM | HAM | 120.4° | 120.0° |
| CAW | CAJ | HAJ | 119.7° | 119.9° |
| CAJ | CAW | CAN | 120.0° | 120.0° |
| CAJ | CAW | CAQ | 118.6° | 120.0° |
| CAX | CAK | HAK | 119.9° | 120.0° |
| CAK | CAX | CAL | 118.5° | 119.9° |
| CAK | CAX | OAS | 122.9° | 120.1° |
| CAX | CAL | HAL | 119.0° | 120.0° |
| CAL | CAX | OAS | 118.5° | 120.1° |
| CAY | CAM | HAM | 120.4° | 120.0° |
| CAM | CAY | CAN | 120.1° | 119.9° |
| CAM | CAY | OAS | 122.6° | 120.1° |
| CAW | CAN | CAY | 119.8° | 119.9° |
| CAW | CAN | HAN | 120.1° | 120.0° |
| CAN | CAW | CAQ | 121.5° | 120.0° |
| CAY | CAN | HAN | 120.1° | 120.0° |
| CAN | CAY | OAS | 117.3° | 120.0° |
| CAP | CAO | CAQ | 113.8° | 109.5° |
| CAP | CAO | HAO | 108.1° | 109.5° |
| CAP | CAO | HAOA | 108.1° | 109.5° |
| CAO | CAP | NAR | 103.0° | 109.5° |
| CAO | CAP | HAP | 111.7° | 109.5° |
| CAO | CAP | HAPA | 111.7° | 109.5° |
| CAQ | CAO | HAO | 108.0° | 109.5° |
| CAQ | CAO | HAOA | 108.1° | 109.4° |
| CAO | CAQ | CAW | 110.6° | 109.5° |
| CAO | CAQ | HAQ | 109.1° | 109.5° |
| CAO | CAQ | HAQA | 109.1° | 109.5° |
| HAO | CAO | HAOA | 110.8° | 109.5° |
| NAR | CAP | HAP | 111.7° | 109.5° |
| NAR | CAP | HAPA | 111.7° | 109.4° |
| CAP | NAR | CAU | 125.8° | 120.0° |
| CAP | NAR | HNAR | 117.1° | 120.0° |
| HAP | CAP | HAPA | 107.2° | 109.5° |
| CAW | CAQ | HAQ | 109.1° | 109.5° |
| CAW | CAQ | HAQA | 109.1° | 109.5° |
| HAQ | CAQ | HAQA | 109.9° | 109.5° |
| CAU | NAR | HNAR | 117.1° | 120.0° |
| CAY | OAS | CAX | 130.1° | 118.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAA | CAT | OAC | CAV | 177.0° | 179.9° |
| OAA | CAT | CAV | OAD | 175.9° | 0.1° |
| OAA | CAT | CAV | CAE | 2.7° | 180.0° |
| HOAA | OAA | CAT | OAC | 0.0° | 0.1° |
| HOAA | OAA | CAT | CAV | 176.6° | 180.0° |
| OAB | CAU | CAE | NAR | 179.2° | 180.0° |
| OAB | CAU | CAE | CAV | 0.3° | 0.0° |
| OAB | CAU | CAE | HAE | 120.3° | 120.0° |
| OAB | CAU | CAE | HAEA | 119.7° | 120.0° |
| OAB | CAU | NAR | CAP | 1.6° | 0.0° |
| OAB | CAU | NAR | HNAR | 178.4° | 180.0° |
| OAC | CAT | CAV | OAD | 1.0° | 180.0° |
| OAC | CAT | CAV | CAE | 179.6° | 0.1° |
| OAD | CAV | CAE | CAU | 0.5° | 0.0° |
| OAD | CAV | CAE | CAT | 178.4° | 179.9° |
| OAD | CAV | CAE | HAE | 119.5° | 120.0° |
| OAD | CAV | CAE | HAEA | 120.5° | 120.0° |
| CAU | CAE | CAV | HAE | 120.0° | 120.0° |
| CAU | CAE | CAV | HAEA | 120.0° | 120.0° |
| CAU | CAE | HAE | HAEA | 116.7° | 120.1° |
| CAE | CAU | NAR | CAP | 179.2° | 180.0° |
| CAE | CAU | NAR | HNAR | 0.9° | 0.0° |
| CAU | CAE | CAV | CAT | 179.0° | 180.0° |
| CAV | CAE | HAE | HAEA | 116.7° | 120.0° |
| CAV | CAE | CAU | NAR | 178.9° | 180.0° |
| HAE | CAE | CAU | NAR | 58.9° | 60.0° |
| HAE | CAE | CAV | CAT | 59.0° | 60.0° |
| HAEA | CAE | CAU | NAR | 61.1° | 60.0° |
| HAEA | CAE | CAV | CAT | 61.0° | 59.9° |
| CAH | CAF | CAG | HAF | 180.0° | 179.6° |
| CAH | CAF | CAG | CAK | 0.7° | 0.3° |
| CAH | CAF | CAG | HAG | 179.3° | 179.8° |
| CAF | CAH | CAL | HAH | 180.0° | 180.0° |
| CAF | CAH | CAL | CAX | 1.5° | 0.0° |
| CAF | CAH | CAL | HAL | 178.5° | 180.0° |
| CAF | CAG | CAK | HAG | 180.0° | 179.9° |
| CAG | CAF | CAH | CAL | 0.6° | 0.3° |
| CAG | CAF | CAH | HAH | 179.4° | 179.7° |
| CAF | CAG | CAK | CAX | 1.1° | 0.1° |
| CAF | CAG | CAK | HAK | 178.9° | 180.0° |
| HAF | CAF | CAG | CAK | 179.3° | 180.0° |
| HAF | CAF | CAG | HAG | 0.7° | 0.1° |
| HAF | CAF | CAH | CAL | 179.4° | 179.9° |
| HAF | CAF | CAH | HAH | 0.6° | 0.0° |
| CAG | CAK | CAX | HAK | 180.0° | 179.9° |
| CAG | CAK | CAX | CAL | 0.3° | 0.2° |
| CAG | CAK | CAX | OAS | 176.1° | 180.0° |
| HAG | CAG | CAK | CAX | 178.8° | 180.0° |
| HAG | CAG | CAK | HAK | 1.1° | 0.1° |
| CAH | CAL | CAX | CAK | 1.1° | 0.2° |
| CAH | CAL | CAX | HAL | 180.0° | 180.0° |
| CAH | CAL | CAX | OAS | 177.5° | 179.9° |
| HAH | CAH | CAL | CAX | 178.5° | 180.0° |
| HAH | CAH | CAL | HAL | 1.5° | 0.1° |
| CAJ | CAI | CAM | HAI | 180.0° | 179.8° |
| CAI | CAJ | CAW | HAJ | 180.0° | 179.9° |
| CAJ | CAI | CAM | CAY | 0.9° | 0.3° |
| CAJ | CAI | CAM | HAM | 179.1° | 179.8° |
| CAI | CAJ | CAW | CAN | 1.2° | 0.1° |
| CAI | CAJ | CAW | CAQ | 179.7° | 180.0° |
| CAM | CAI | CAJ | CAW | 1.1° | 0.0° |
| CAM | CAI | CAJ | HAJ | 178.9° | 180.0° |
| CAI | CAM | CAY | HAM | 180.0° | 180.0° |
| CAI | CAM | CAY | CAN | 0.9° | 0.6° |
| CAI | CAM | CAY | OAS | 179.9° | 180.0° |
| HAI | CAI | CAJ | CAW | 178.9° | 179.7° |
| HAI | CAI | CAJ | HAJ | 1.1° | 0.2° |
| HAI | CAI | CAM | CAY | 179.1° | 180.0° |
| HAI | CAI | CAM | HAM | 0.9° | 0.0° |
| CAJ | CAW | CAN | CAQ | 179.1° | 180.0° |
| CAJ | CAW | CAN | CAY | 1.1° | 0.3° |
| CAJ | CAW | CAN | HAN | 178.8° | 179.7° |
| CAJ | CAW | CAQ | CAO | 69.2° | 90.0° |
| CAJ | CAW | CAQ | HAQ | 170.8° | 30.0° |
| CAJ | CAW | CAQ | HAQA | 50.9° | 150.0° |
| HAJ | CAJ | CAW | CAN | 178.8° | 180.0° |
| HAJ | CAJ | CAW | CAQ | 0.3° | 0.1° |
| CAK | CAX | CAL | OAS | 176.5° | 179.8° |
| CAK | CAX | CAL | HAL | 179.0° | 179.8° |
| CAK | CAX | OAS | CAY | 73.5° | 0.4° |
| HAK | CAK | CAX | CAL | 179.7° | 179.8° |
| HAK | CAK | CAX | OAS | 3.9° | 0.1° |
| CAL | CAX | OAS | CAY | 110.2° | 179.5° |
| HAL | CAL | CAX | OAS | 2.5° | 0.0° |
| CAM | CAY | CAN | CAW | 1.0° | 0.6° |
| CAM | CAY | CAN | OAS | 179.1° | 179.4° |
| CAM | CAY | CAN | HAN | 179.0° | 180.0° |
| CAM | CAY | OAS | CAX | 9.2° | 90.2° |
| HAM | CAM | CAY | CAN | 179.2° | 179.5° |
| HAM | CAM | CAY | OAS | 0.1° | 0.0° |
| CAW | CAN | CAY | HAN | 180.0° | 179.5° |
| CAN | CAW | CAQ | CAO | 109.9° | 90.0° |
| CAN | CAW | CAQ | HAQ | 10.1° | 150.0° |
| CAN | CAW | CAQ | HAQA | 130.1° | 30.0° |
| CAW | CAN | CAY | OAS | 179.9° | 180.0° |
| CAY | CAN | CAW | CAQ | 179.8° | 179.7° |
| CAN | CAY | OAS | CAX | 171.7° | 90.4° |
| HAN | CAN | CAW | CAQ | 0.2° | 0.2° |
| HAN | CAN | CAY | OAS | 0.1° | 0.5° |
| CAP | CAO | CAQ | HAO | 120.0° | 120.0° |
| CAP | CAO | CAQ | HAOA | 120.0° | 120.0° |
| CAP | CAO | HAO | HAOA | 118.3° | 120.1° |
| CAO | CAP | NAR | HAP | 120.0° | 120.0° |
| CAO | CAP | NAR | HAPA | 120.0° | 120.0° |
| CAO | CAP | HAP | HAPA | 122.6° | 120.0° |
| CAP | CAO | CAQ | CAW | 76.4° | 180.0° |
| CAP | CAO | CAQ | HAQ | 43.6° | 60.0° |
| CAP | CAO | CAQ | HAQA | 163.6° | 60.0° |
| CAO | CAP | NAR | CAU | 101.0° | 180.0° |
| CAO | CAP | NAR | HNAR | 79.1° | 0.0° |
| CAQ | CAO | HAO | HAOA | 118.2° | 120.0° |
| CAQ | CAO | CAP | NAR | 122.2° | 180.0° |
| CAQ | CAO | CAP | HAP | 117.8° | 60.0° |
| CAQ | CAO | CAP | HAPA | 2.2° | 60.0° |
| CAO | CAQ | CAW | HAQ | 120.0° | 120.0° |
| CAO | CAQ | CAW | HAQA | 120.0° | 120.0° |
| CAO | CAQ | HAQ | HAQA | 119.6° | 120.0° |
| HAO | CAO | CAP | NAR | 117.8° | 60.0° |
| HAO | CAO | CAP | HAP | 2.2° | 60.0° |
| HAO | CAO | CAP | HAPA | 122.2° | NaN° |
| HAO | CAO | CAQ | CAW | 163.6° | 60.0° |
| HAO | CAO | CAQ | HAQ | 76.4° | 180.0° |
| HAO | CAO | CAQ | HAQA | 43.6° | 60.0° |
| HAOA | CAO | CAP | NAR | 2.2° | 60.0° |
| HAOA | CAO | CAP | HAP | 122.2° | 180.0° |
| HAOA | CAO | CAP | HAPA | 117.8° | 59.9° |
| HAOA | CAO | CAQ | CAW | 43.7° | 60.0° |
| HAOA | CAO | CAQ | HAQ | 163.6° | 60.0° |
| HAOA | CAO | CAQ | HAQA | 76.3° | 180.0° |
| NAR | CAP | HAP | HAPA | 122.6° | 120.0° |
| CAP | NAR | CAU | HNAR | 180.0° | 180.0° |
| HAP | CAP | NAR | CAU | 19.0° | 60.0° |
| HAP | CAP | NAR | HNAR | 161.0° | 120.0° |
| HAPA | CAP | NAR | CAU | 139.0° | 60.0° |
| HAPA | CAP | NAR | HNAR | 40.9° | 120.0° |
| CAW | CAQ | HAQ | HAQA | 119.5° | 120.0° |
