F6N
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O | C | doub | 1.22Å | 1.23Å | |
C5 | CA2 | doub | 1.36Å | 1.39Å | Aromatic |
C5 | O3 | sing | 1.34Å | 1.37Å | Aromatic |
C | CA2 | sing | 1.47Å | 1.51Å | |
CA2 | N2 | sing | 1.36Å | 1.39Å | Aromatic |
O3 | C2 | sing | 1.34Å | 1.36Å | Aromatic |
N2 | C2 | doub | 1.30Å | 1.29Å | Aromatic |
C2 | CA1 | sing | 1.51Å | 1.50Å | |
CA1 | N | sing | 1.47Å | 1.48Å | |
N | H | sing | 1.01Å | 1.00Å | |
N | H2 | sing | 1.01Å | 1.00Å | |
CA1 | H4 | sing | 1.09Å | 1.10Å | |
CA1 | H5 | sing | 1.09Å | 1.10Å | |
C5 | H7 | sing | 1.08Å | 1.08Å | |
C | OXT | sing | 1.35Å | 1.35Å | |
OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O | C | CA2 | 118.8° | 120.0° |
O | C | OXT | 123.6° | 120.0° |
CA2 | C5 | O3 | 107.6° | 106.9° |
C5 | CA2 | C | 131.9° | 126.5° |
C5 | CA2 | N2 | 106.7° | 107.1° |
CA2 | C5 | H7 | 126.2° | 126.5° |
C5 | O3 | C2 | 105.9° | 108.3° |
O3 | C5 | H7 | 126.2° | 126.6° |
C | CA2 | N2 | 121.4° | 126.4° |
CA2 | C | OXT | 117.5° | 120.0° |
CA2 | N2 | C2 | 107.5° | 108.5° |
O3 | C2 | N2 | 112.2° | 109.3° |
O3 | C2 | CA1 | 122.2° | 125.4° |
N2 | C2 | CA1 | 125.5° | 125.4° |
C2 | CA1 | N | 113.1° | 109.5° |
C2 | CA1 | H4 | 108.6° | 109.4° |
C2 | CA1 | H5 | 108.5° | 109.5° |
CA1 | N | H | 109.5° | 111.0° |
CA1 | N | H2 | 109.4° | 111.0° |
N | CA1 | H4 | 108.6° | 109.5° |
N | CA1 | H5 | 108.6° | 109.5° |
H | N | H2 | 109.5° | 111.0° |
H4 | CA1 | H5 | 109.4° | 109.4° |
C | OXT | HXT | 109.5° | 116.9° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O | C | CA2 | C5 | 5.7° | 0.0° |
O | C | CA2 | OXT | 177.2° | 180.0° |
O | C | CA2 | N2 | 172.0° | 180.0° |
O | C | OXT | HXT | 0.0° | 0.0° |
CA2 | C5 | O3 | H7 | 180.0° | 179.8° |
C5 | CA2 | C | N2 | 177.7° | 179.9° |
CA2 | C5 | O3 | C2 | 0.2° | 0.4° |
C5 | CA2 | N2 | C2 | 0.0° | 0.0° |
C5 | CA2 | C | OXT | 177.1° | 180.0° |
O3 | C5 | CA2 | C | 177.8° | 179.7° |
O3 | C5 | CA2 | N2 | 0.1° | 0.2° |
C5 | O3 | C2 | N2 | 0.3° | 0.5° |
C5 | O3 | C2 | CA1 | 179.6° | 179.8° |
C | CA2 | N2 | C2 | 178.3° | 180.0° |
C | CA2 | C5 | H7 | 2.2° | 0.1° |
CA2 | C | OXT | HXT | 177.0° | 180.0° |
CA2 | N2 | C2 | O3 | 0.2° | 0.3° |
CA2 | N2 | C2 | CA1 | 179.4° | 180.0° |
N2 | CA2 | C5 | H7 | 179.9° | 180.0° |
N2 | CA2 | C | OXT | 5.2° | 0.1° |
O3 | C2 | N2 | CA1 | 179.2° | 179.7° |
O3 | C2 | CA1 | N | 159.5° | 90.3° |
O3 | C2 | CA1 | H4 | 39.0° | 149.7° |
O3 | C2 | CA1 | H5 | 79.9° | 29.7° |
C2 | O3 | C5 | H7 | 179.8° | 179.8° |
N2 | C2 | CA1 | N | 19.7° | 90.0° |
N2 | C2 | CA1 | H4 | 140.2° | 30.0° |
N2 | C2 | CA1 | H5 | 100.9° | 149.9° |
C2 | CA1 | N | H4 | 120.6° | 120.0° |
C2 | CA1 | N | H5 | 120.5° | 120.0° |
C2 | CA1 | N | H | 180.0° | 180.0° |
C2 | CA1 | N | H2 | 60.0° | 56.1° |
C2 | CA1 | H4 | H5 | 118.3° | 120.0° |
CA1 | N | H | H2 | 120.0° | 123.9° |
N | CA1 | H4 | H5 | 118.4° | 120.1° |
H | N | CA1 | H4 | 59.4° | 60.0° |
H | N | CA1 | H5 | 59.5° | 60.0° |
H2 | N | CA1 | H4 | 179.4° | 63.9° |
H2 | N | CA1 | H5 | 60.5° | 176.1° |