ORX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OA | CA | sing | 1.34Å | 1.36Å | |
| OA | HOA | sing | 0.97Å | 0.95Å | |
| CA | OXT | doub | 1.21Å | 1.37Å | |
| CA | CAA | sing | 1.51Å | 1.56Å | |
| CAA | NA | sing | 1.47Å | 1.57Å | |
| CAA | CBA | sing | 1.53Å | 1.55Å | |
| CAA | HAA | sing | 1.09Å | 1.12Å | |
| NA | C4A | sing | 1.47Å | 1.53Å | |
| NA | HNA | sing | 1.01Å | 1.02Å | |
| C4A | C4 | sing | 1.51Å | 1.58Å | |
| C4A | H4A1 | sing | 1.09Å | 1.11Å | |
| C4A | H4A2 | sing | 1.09Å | 1.12Å | |
| C4 | C5 | doub | 1.38Å | 1.45Å | Aromatic |
| C4 | C3 | sing | 1.39Å | 1.44Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C5A | sing | 1.51Å | 1.49Å | |
| C6 | N1 | doub | 1.32Å | 1.37Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.10Å | |
| N1 | C2 | sing | 1.32Å | 1.40Å | Aromatic |
| C2 | C3 | doub | 1.39Å | 1.49Å | Aromatic |
| C2 | C2A | sing | 1.51Å | 1.52Å | |
| C3 | O3 | sing | 1.36Å | 1.36Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C2A | H2A1 | sing | 1.09Å | 1.12Å | |
| C2A | H2A2 | sing | 1.09Å | 1.11Å | |
| C2A | H2A3 | sing | 1.09Å | 1.12Å | |
| C5A | OP4 | sing | 1.43Å | 1.36Å | |
| C5A | H5A1 | sing | 1.09Å | 1.12Å | |
| C5A | H5A2 | sing | 1.09Å | 1.11Å | |
| OP4 | P | sing | 1.61Å | 1.57Å | |
| P | OP1 | doub | 1.48Å | 1.44Å | |
| P | OP2 | sing | 1.61Å | 1.53Å | |
| P | OP3 | sing | 1.61Å | 1.51Å | |
| OP2 | HP2 | sing | 0.97Å | 0.95Å | |
| OP3 | HP3 | sing | 0.97Å | 0.95Å | |
| CBA | CGA | sing | 1.53Å | 1.52Å | |
| CBA | HBA1 | sing | 1.09Å | 1.12Å | |
| CBA | HBA2 | sing | 1.09Å | 1.11Å | |
| CGA | CDA | sing | 1.53Å | 1.53Å | |
| CGA | HGA1 | sing | 1.09Å | 1.12Å | |
| CGA | HGA2 | sing | 1.09Å | 1.11Å | |
| CDA | NE | sing | 1.47Å | 1.48Å | |
| CDA | HDA1 | sing | 1.09Å | 1.11Å | |
| CDA | HDA2 | sing | 1.09Å | 1.12Å | |
| NE | HNE1 | sing | 1.01Å | 1.02Å | |
| NE | HNE2 | sing | 1.01Å | 1.02Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | OA | HOA | 119.4° | 119.9° |
| OA | CA | OXT | 119.4° | 120.0° |
| OA | CA | CAA | 119.7° | 120.0° |
| OXT | CA | CAA | 120.9° | 120.0° |
| CA | CAA | NA | 112.2° | 109.5° |
| CA | CAA | CBA | 107.9° | 109.5° |
| CA | CAA | HAA | 111.0° | 109.5° |
| NA | CAA | CBA | 115.5° | 109.5° |
| NA | CAA | HAA | 102.7° | 109.4° |
| CAA | NA | C4A | 113.7° | 106.7° |
| CAA | NA | HNA | 110.7° | 106.7° |
| CBA | CAA | HAA | 107.5° | 109.4° |
| CAA | CBA | CGA | 115.8° | 109.5° |
| CAA | CBA | HBA1 | 109.9° | 109.5° |
| CAA | CBA | HBA2 | 109.9° | 109.5° |
| C4A | NA | HNA | 110.7° | 106.7° |
| NA | C4A | C4 | 113.4° | 109.4° |
| NA | C4A | H4A1 | 110.8° | 109.4° |
| NA | C4A | H4A2 | 110.7° | 109.6° |
| C4 | C4A | H4A1 | 110.8° | 109.4° |
| C4 | C4A | H4A2 | 110.8° | 109.5° |
| C4A | C4 | C5 | 123.7° | 120.8° |
| C4A | C4 | C3 | 126.6° | 120.8° |
| H4A1 | C4A | H4A2 | 99.5° | 109.5° |
| C5 | C4 | C3 | 109.6° | 118.4° |
| C4 | C5 | C6 | 128.2° | 119.2° |
| C4 | C5 | C5A | 121.1° | 120.4° |
| C4 | C3 | C2 | 123.9° | 119.1° |
| C4 | C3 | O3 | 124.2° | 120.4° |
| C6 | C5 | C5A | 110.7° | 120.4° |
| C5 | C6 | N1 | 119.6° | 120.9° |
| C5 | C6 | H6 | 120.9° | 119.6° |
| C5 | C5A | OP4 | 115.8° | 109.5° |
| C5 | C5A | H5A1 | 109.9° | 109.4° |
| C5 | C5A | H5A2 | 109.9° | 109.4° |
| N1 | C6 | H6 | 119.6° | 119.5° |
| C6 | N1 | C2 | 120.5° | 121.7° |
| N1 | C2 | C3 | 118.3° | 120.7° |
| N1 | C2 | C2A | 107.9° | 119.6° |
| C3 | C2 | C2A | 133.8° | 119.7° |
| C2 | C3 | O3 | 111.9° | 120.5° |
| C2 | C2A | H2A1 | 107.9° | 109.5° |
| C2 | C2A | H2A2 | 112.8° | 109.5° |
| C2 | C2A | H2A3 | 112.8° | 109.5° |
| C3 | O3 | HO3 | 124.2° | 106.8° |
| H2A1 | C2A | H2A2 | 112.8° | 109.4° |
| H2A1 | C2A | H2A3 | 112.7° | 109.5° |
| H2A2 | C2A | H2A3 | 97.6° | 109.5° |
| OP4 | C5A | H5A1 | 109.9° | 109.5° |
| OP4 | C5A | H5A2 | 109.9° | 109.5° |
| C5A | OP4 | P | 120.6° | 106.9° |
| H5A1 | C5A | H5A2 | 100.3° | 109.5° |
| OP4 | P | OP1 | 111.4° | 109.4° |
| OP4 | P | OP2 | 103.7° | 109.5° |
| OP4 | P | OP3 | 103.5° | 109.5° |
| OP1 | P | OP2 | 120.4° | 109.5° |
| OP1 | P | OP3 | 105.3° | 109.5° |
| OP2 | P | OP3 | 111.5° | 109.5° |
| P | OP2 | HP2 | 103.6° | 106.8° |
| P | OP3 | HP3 | 103.5° | 106.8° |
| CGA | CBA | HBA1 | 109.9° | 109.5° |
| CGA | CBA | HBA2 | 110.0° | 109.5° |
| CBA | CGA | CDA | 111.5° | 109.4° |
| CBA | CGA | HGA1 | 111.4° | 109.5° |
| CBA | CGA | HGA2 | 111.4° | 109.5° |
| HBA1 | CBA | HBA2 | 100.3° | 109.5° |
| CDA | CGA | HGA1 | 111.4° | 109.5° |
| CDA | CGA | HGA2 | 111.5° | 109.5° |
| CGA | CDA | NE | 109.4° | 109.5° |
| CGA | CDA | HDA1 | 112.2° | 109.5° |
| CGA | CDA | HDA2 | 112.2° | 109.5° |
| HGA1 | CGA | HGA2 | 98.9° | 109.5° |
| NE | CDA | HDA1 | 112.2° | 109.5° |
| NE | CDA | HDA2 | 112.3° | 109.4° |
| CDA | NE | HNE1 | 109.4° | 106.7° |
| CDA | NE | HNE2 | 112.2° | 106.6° |
| HDA1 | CDA | HDA2 | 98.2° | 109.4° |
| HNE1 | NE | HNE2 | 112.3° | 106.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OA | CA | OXT | CAA | 180.0° | 180.0° |
| OA | CA | CAA | NA | 131.3° | 30.0° |
| OA | CA | CAA | CBA | 100.5° | 90.0° |
| OA | CA | CAA | HAA | 17.1° | 150.0° |
| HOA | OA | CA | OXT | 179.9° | 0.0° |
| HOA | OA | CA | CAA | 0.0° | 180.0° |
| OXT | CA | CAA | NA | 48.7° | 149.9° |
| OXT | CA | CAA | CBA | 79.6° | 90.0° |
| OXT | CA | CAA | HAA | 162.9° | 30.0° |
| CA | CAA | NA | CBA | 124.1° | 120.0° |
| CA | CAA | NA | HAA | 119.2° | 120.0° |
| CA | CAA | CBA | HAA | 119.8° | 120.0° |
| CA | CAA | NA | C4A | 64.6° | 89.9° |
| CA | CAA | NA | HNA | 170.1° | 23.8° |
| CA | CAA | CBA | CGA | 84.6° | 180.0° |
| CA | CAA | CBA | HBA1 | 40.6° | 60.0° |
| CA | CAA | CBA | HBA2 | 150.1° | 60.0° |
| NA | CAA | CBA | HAA | 113.9° | 119.9° |
| CAA | NA | C4A | HNA | 125.3° | 113.7° |
| CAA | NA | C4A | C4 | 162.8° | 180.0° |
| CAA | NA | C4A | H4A1 | 71.9° | 60.1° |
| CAA | NA | C4A | H4A2 | 37.6° | 60.0° |
| NA | CAA | CBA | CGA | 149.0° | 60.0° |
| NA | CAA | CBA | HBA1 | 85.7° | 60.0° |
| NA | CAA | CBA | HBA2 | 23.7° | 180.0° |
| CBA | CAA | NA | C4A | 59.6° | 150.0° |
| CBA | CAA | NA | HNA | 65.7° | 96.2° |
| CAA | CBA | CGA | HBA1 | 125.2° | 120.0° |
| CAA | CBA | CGA | HBA2 | 125.2° | 120.0° |
| CAA | CBA | HBA1 | HBA2 | 115.7° | 120.0° |
| CAA | CBA | CGA | CDA | 122.4° | 180.0° |
| CAA | CBA | CGA | HGA1 | 2.9° | 60.0° |
| CAA | CBA | CGA | HGA2 | 112.4° | 60.0° |
| HAA | CAA | NA | C4A | 176.2° | 30.1° |
| HAA | CAA | NA | HNA | 50.9° | 143.8° |
| HAA | CAA | CBA | CGA | 35.2° | 60.0° |
| HAA | CAA | CBA | HBA1 | 160.4° | 179.9° |
| HAA | CAA | CBA | HBA2 | 90.1° | 60.0° |
| NA | C4A | C4 | H4A1 | 125.3° | 119.9° |
| NA | C4A | C4 | H4A2 | 125.2° | 120.1° |
| NA | C4A | H4A1 | H4A2 | 116.6° | 120.1° |
| NA | C4A | C4 | C5 | 145.1° | 90.1° |
| NA | C4A | C4 | C3 | 35.5° | 89.7° |
| HNA | NA | C4A | C4 | 71.9° | 66.3° |
| HNA | NA | C4A | H4A1 | 53.4° | 173.8° |
| HNA | NA | C4A | H4A2 | 162.9° | 53.7° |
| C4 | C4A | H4A1 | H4A2 | 116.6° | 120.0° |
| C4A | C4 | C5 | C3 | 179.5° | 179.8° |
| C4A | C4 | C5 | C6 | 179.7° | 180.0° |
| C4A | C4 | C5 | C5A | 0.1° | 0.0° |
| C4A | C4 | C3 | C2 | 179.4° | 179.7° |
| C4A | C4 | C3 | O3 | 0.6° | 0.2° |
| H4A1 | C4A | C4 | C5 | 19.8° | 150.0° |
| H4A1 | C4A | C4 | C3 | 160.8° | 30.2° |
| H4A2 | C4A | C4 | C5 | 89.7° | 30.0° |
| H4A2 | C4A | C4 | C3 | 89.8° | 150.2° |
| C4 | C5 | C6 | C5A | 179.6° | 180.0° |
| C4 | C5 | C6 | N1 | 1.0° | 0.0° |
| C4 | C5 | C6 | H6 | 179.0° | 180.0° |
| C5 | C4 | C3 | C2 | 0.1° | 0.5° |
| C5 | C4 | C3 | O3 | 178.9° | 180.0° |
| C4 | C5 | C5A | OP4 | 49.0° | 180.0° |
| C4 | C5 | C5A | H5A1 | 174.3° | 60.0° |
| C4 | C5 | C5A | H5A2 | 76.2° | 60.0° |
| C3 | C4 | C5 | C6 | 0.8° | 0.2° |
| C3 | C4 | C5 | C5A | 179.6° | 179.7° |
| C4 | C3 | C2 | N1 | 0.7° | 0.6° |
| C4 | C3 | C2 | O3 | 179.0° | 179.4° |
| C4 | C3 | C2 | C2A | 180.0° | 179.8° |
| C4 | C3 | O3 | HO3 | 180.0° | 90.1° |
| C5 | C6 | N1 | H6 | 180.0° | 180.0° |
| C5 | C6 | N1 | C2 | 0.3° | 0.0° |
| C6 | C5 | C5A | OP4 | 131.3° | 0.0° |
| C6 | C5 | C5A | H5A1 | 6.1° | 120.0° |
| C6 | C5 | C5A | H5A2 | 103.4° | 120.0° |
| C5A | C5 | C6 | N1 | 179.4° | 180.0° |
| C5A | C5 | C6 | H6 | 0.6° | 0.0° |
| C5 | C5A | OP4 | H5A1 | 125.2° | 120.0° |
| C5 | C5A | OP4 | H5A2 | 125.3° | 120.0° |
| C5 | C5A | H5A1 | H5A2 | 115.7° | 119.9° |
| C5 | C5A | OP4 | P | 174.2° | 180.0° |
| C6 | N1 | C2 | C3 | 0.5° | 0.3° |
| C6 | N1 | C2 | C2A | 180.0° | 180.0° |
| H6 | C6 | N1 | C2 | 179.7° | 180.0° |
| N1 | C2 | C3 | C2A | 179.3° | 179.7° |
| N1 | C2 | C3 | O3 | 179.6° | 180.0° |
| N1 | C2 | C2A | H2A1 | 180.0° | 90.0° |
| N1 | C2 | C2A | H2A2 | 54.7° | 150.0° |
| N1 | C2 | C2A | H2A3 | 54.8° | 30.0° |
| C2 | C3 | O3 | HO3 | 1.1° | 90.5° |
| C3 | C2 | C2A | H2A1 | 0.6° | 90.3° |
| C3 | C2 | C2A | H2A2 | 124.7° | 29.7° |
| C3 | C2 | C2A | H2A3 | 125.8° | 149.7° |
| C2A | C2 | C3 | O3 | 1.0° | 0.3° |
| C2 | C2A | H2A1 | H2A2 | 125.3° | 120.0° |
| C2 | C2A | H2A1 | H2A3 | 125.3° | 120.0° |
| C2 | C2A | H2A2 | H2A3 | 118.7° | 120.0° |
| H2A1 | C2A | H2A2 | H2A3 | 118.6° | 120.0° |
| OP4 | C5A | H5A1 | H5A2 | 115.7° | 120.0° |
| C5A | OP4 | P | OP1 | 177.9° | 60.0° |
| C5A | OP4 | P | OP2 | 47.0° | 180.0° |
| C5A | OP4 | P | OP3 | 69.4° | 60.0° |
| H5A1 | C5A | OP4 | P | 48.9° | 60.0° |
| H5A2 | C5A | OP4 | P | 60.6° | 60.0° |
| OP4 | P | OP1 | OP2 | 121.6° | 120.0° |
| OP4 | P | OP1 | OP3 | 111.5° | 120.0° |
| OP4 | P | OP2 | OP3 | 110.7° | 120.0° |
| OP4 | P | OP2 | HP2 | 180.0° | 180.0° |
| OP4 | P | OP3 | HP3 | 180.0° | 60.0° |
| OP1 | P | OP2 | OP3 | 124.0° | 120.0° |
| OP1 | P | OP2 | HP2 | 54.7° | 60.0° |
| OP1 | P | OP3 | HP3 | 62.9° | 180.0° |
| OP2 | P | OP3 | HP3 | 69.2° | 60.0° |
| OP3 | P | OP2 | HP2 | 69.3° | 60.0° |
| CGA | CBA | HBA1 | HBA2 | 115.8° | 120.0° |
| CBA | CGA | CDA | HGA1 | 125.3° | 120.0° |
| CBA | CGA | CDA | HGA2 | 125.3° | 120.0° |
| CBA | CGA | HGA1 | HGA2 | 117.3° | 120.0° |
| CBA | CGA | CDA | NE | 178.2° | 180.0° |
| CBA | CGA | CDA | HDA1 | 53.0° | 59.9° |
| CBA | CGA | CDA | HDA2 | 56.5° | 60.0° |
| HBA1 | CBA | CGA | CDA | 112.4° | 60.0° |
| HBA1 | CBA | CGA | HGA1 | 122.3° | 180.0° |
| HBA1 | CBA | CGA | HGA2 | 12.9° | 60.0° |
| HBA2 | CBA | CGA | CDA | 2.9° | 60.0° |
| HBA2 | CBA | CGA | HGA1 | 128.1° | 60.0° |
| HBA2 | CBA | CGA | HGA2 | 122.4° | 180.0° |
| CDA | CGA | HGA1 | HGA2 | 117.4° | 120.0° |
| CGA | CDA | NE | HDA1 | 125.2° | 120.1° |
| CGA | CDA | NE | HDA2 | 125.2° | 120.0° |
| CGA | CDA | HDA1 | HDA2 | 118.1° | 120.0° |
| CGA | CDA | NE | HNE1 | 180.0° | 180.0° |
| CGA | CDA | NE | HNE2 | 54.7° | 66.3° |
| HGA1 | CGA | CDA | NE | 56.5° | 60.0° |
| HGA1 | CGA | CDA | HDA1 | 178.2° | 180.0° |
| HGA1 | CGA | CDA | HDA2 | 68.8° | 60.0° |
| HGA2 | CGA | CDA | NE | 53.0° | 60.1° |
| HGA2 | CGA | CDA | HDA1 | 72.3° | 60.0° |
| HGA2 | CGA | CDA | HDA2 | 178.3° | 180.0° |
| NE | CDA | HDA1 | HDA2 | 118.2° | 119.9° |
| CDA | NE | HNE1 | HNE2 | 125.3° | 113.7° |
| HDA1 | CDA | NE | HNE1 | 54.8° | 59.9° |
| HDA1 | CDA | NE | HNE2 | 70.6° | 53.8° |
| HDA2 | CDA | NE | HNE1 | 54.7° | 60.0° |
| HDA2 | CDA | NE | HNE2 | 179.9° | 173.8° |
