LFN
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N1 | C2 | sing | 1.33Å | 1.35Å | Aromatic |
N1 | C10 | doub | 1.32Å | 1.38Å | Aromatic |
C2 | O2 | doub | 1.22Å | 1.26Å | |
C2 | N3 | sing | 1.34Å | 1.36Å | Aromatic |
C10 | C4A | sing | 1.47Å | 1.48Å | Aromatic |
C10 | N10 | sing | 1.36Å | 1.32Å | Aromatic |
N3 | C4 | sing | 1.35Å | 1.33Å | Aromatic |
N3 | H3 | sing | 0.97Å | 1.02Å | |
C4 | O4 | doub | 1.22Å | 1.26Å | |
C4 | C4A | sing | 1.48Å | 1.48Å | Aromatic |
C4A | N5 | doub | 1.31Å | 1.36Å | Aromatic |
N5 | C5A | sing | 1.34Å | 1.35Å | Aromatic |
C5A | C6 | doub | 1.41Å | 1.39Å | Aromatic |
C5A | C9A | sing | 1.41Å | 1.50Å | Aromatic |
C6 | C7 | sing | 1.36Å | 1.40Å | Aromatic |
C6 | H6 | sing | 1.08Å | 1.10Å | |
C9A | C9 | doub | 1.39Å | 1.41Å | Aromatic |
C9A | N10 | sing | 1.38Å | 1.34Å | Aromatic |
C7 | C7M | sing | 1.51Å | 1.53Å | |
C7 | C8 | doub | 1.39Å | 1.47Å | Aromatic |
C7M | H7M1 | sing | 1.09Å | 1.12Å | |
C7M | H7M2 | sing | 1.09Å | 1.12Å | |
C7M | H7M3 | sing | 1.09Å | 1.11Å | |
C8 | C8M | sing | 1.51Å | 1.52Å | |
C8 | C9 | sing | 1.38Å | 1.40Å | Aromatic |
C8M | H8M1 | sing | 1.09Å | 1.12Å | |
C8M | H8M2 | sing | 1.09Å | 1.11Å | |
C8M | H8M3 | sing | 1.09Å | 1.11Å | |
C9 | H9 | sing | 1.08Å | 1.10Å | |
N10 | C1' | sing | 1.47Å | 1.48Å | |
C1' | H1'1 | sing | 1.09Å | 1.11Å | |
C1' | H1'2 | sing | 1.09Å | 1.12Å | |
C1' | H1'3 | sing | 1.09Å | 1.11Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | N1 | C10 | 119.8° | 121.5° |
N1 | C2 | O2 | 118.6° | 118.0° |
N1 | C2 | N3 | 122.1° | 124.1° |
N1 | C10 | C4A | 119.9° | 118.7° |
N1 | C10 | N10 | 121.3° | 122.2° |
O2 | C2 | N3 | 119.4° | 117.9° |
C2 | N3 | C4 | 124.1° | 121.3° |
C2 | N3 | H3 | 118.0° | 119.3° |
C4A | C10 | N10 | 118.8° | 119.0° |
C10 | C4A | C4 | 116.1° | 117.3° |
C10 | C4A | N5 | 121.4° | 120.5° |
C10 | N10 | C9A | 121.7° | 118.5° |
C10 | N10 | C1' | 118.5° | 120.8° |
C4 | N3 | H3 | 118.0° | 119.4° |
N3 | C4 | O4 | 121.7° | 121.4° |
N3 | C4 | C4A | 118.0° | 117.2° |
O4 | C4 | C4A | 120.2° | 121.5° |
C4 | C4A | N5 | 122.5° | 122.2° |
C4A | N5 | C5A | 118.8° | 120.7° |
N5 | C5A | C6 | 121.3° | 119.8° |
N5 | C5A | C9A | 119.3° | 121.0° |
C6 | C5A | C9A | 119.4° | 119.2° |
C5A | C6 | C7 | 120.4° | 119.9° |
C5A | C6 | H6 | 119.8° | 120.1° |
C5A | C9A | C9 | 120.3° | 119.6° |
C5A | C9A | N10 | 120.0° | 120.3° |
C7 | C6 | H6 | 119.8° | 120.0° |
C6 | C7 | C7M | 119.6° | 119.7° |
C6 | C7 | C8 | 120.4° | 120.8° |
C9 | C9A | N10 | 119.7° | 120.1° |
C9A | C9 | C8 | 119.0° | 119.9° |
C9A | C9 | H9 | 120.5° | 120.1° |
C9A | N10 | C1' | 119.8° | 120.7° |
C7M | C7 | C8 | 119.9° | 119.6° |
C7 | C7M | H7M1 | 119.6° | 109.5° |
C7 | C7M | H7M2 | 108.6° | 109.5° |
C7 | C7M | H7M3 | 108.5° | 109.5° |
C7 | C8 | C8M | 119.8° | 119.7° |
C7 | C8 | C9 | 120.5° | 120.6° |
H7M1 | C7M | H7M2 | 108.5° | 109.4° |
H7M1 | C7M | H7M3 | 108.6° | 109.4° |
H7M2 | C7M | H7M3 | 101.4° | 109.5° |
C8M | C8 | C9 | 119.6° | 119.7° |
C8 | C8M | H8M1 | 119.8° | 109.5° |
C8 | C8M | H8M2 | 108.5° | 109.5° |
C8 | C8M | H8M3 | 108.5° | 109.5° |
C8 | C9 | H9 | 120.5° | 120.0° |
H8M1 | C8M | H8M2 | 108.5° | 109.5° |
H8M1 | C8M | H8M3 | 108.5° | 109.5° |
H8M2 | C8M | H8M3 | 101.5° | 109.5° |
N10 | C1' | H1'1 | 118.5° | 109.5° |
N10 | C1' | H1'2 | 109.0° | 109.4° |
N10 | C1' | H1'3 | 109.0° | 109.5° |
H1'1 | C1' | H1'2 | 109.0° | 109.4° |
H1'1 | C1' | H1'3 | 109.0° | 109.5° |
H1'2 | C1' | H1'3 | 101.1° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N1 | C2 | O2 | N3 | 179.2° | 180.0° |
C2 | N1 | C10 | C4A | 0.8° | 0.5° |
C2 | N1 | C10 | N10 | 179.4° | 179.7° |
N1 | C2 | N3 | C4 | 2.2° | 0.1° |
N1 | C2 | N3 | H3 | 177.8° | 180.0° |
C10 | N1 | C2 | O2 | 179.5° | 179.7° |
C10 | N1 | C2 | N3 | 1.3° | 0.3° |
N1 | C10 | C4A | N10 | 178.6° | 179.2° |
N1 | C10 | C4A | C4 | 1.1° | 0.4° |
N1 | C10 | C4A | N5 | 179.7° | 179.8° |
N1 | C10 | N10 | C9A | 179.5° | 179.8° |
N1 | C10 | N10 | C1' | 0.7° | 0.6° |
O2 | C2 | N3 | C4 | 178.6° | 180.0° |
O2 | C2 | N3 | H3 | 1.4° | 0.0° |
C2 | N3 | C4 | H3 | 180.0° | 180.0° |
C2 | N3 | C4 | O4 | 179.4° | 180.0° |
C2 | N3 | C4 | C4A | 2.4° | 0.0° |
C10 | C4A | C4 | N3 | 1.8° | 0.2° |
C10 | C4A | C4 | O4 | 180.0° | 179.8° |
C10 | C4A | C4 | N5 | 178.6° | 179.8° |
C10 | C4A | N5 | C5A | 1.8° | 0.2° |
C4A | C10 | N10 | C9A | 1.0° | 0.5° |
C4A | C10 | N10 | C1' | 179.3° | 179.8° |
N10 | C10 | C4A | C4 | 179.7° | 179.7° |
N10 | C10 | C4A | N5 | 1.7° | 0.5° |
C10 | N10 | C9A | C5A | 0.4° | 0.3° |
C10 | N10 | C9A | C9 | 179.2° | 179.7° |
C10 | N10 | C9A | C1' | 179.7° | 179.7° |
C10 | N10 | C1' | H1'1 | 180.0° | 90.3° |
C10 | N10 | C1' | H1'2 | 54.7° | 29.7° |
C10 | N10 | C1' | H1'3 | 54.7° | 149.7° |
N3 | C4 | O4 | C4A | 178.1° | 180.0° |
N3 | C4 | C4A | N5 | 179.6° | 180.0° |
H3 | N3 | C4 | O4 | 0.6° | 0.0° |
H3 | N3 | C4 | C4A | 177.6° | 180.0° |
O4 | C4 | C4A | N5 | 1.4° | 0.0° |
C4 | C4A | N5 | C5A | 179.7° | 180.0° |
C4A | N5 | C5A | C6 | 179.3° | 180.0° |
C4A | N5 | C5A | C9A | 1.2° | 0.0° |
N5 | C5A | C6 | C9A | 179.4° | 180.0° |
N5 | C5A | C6 | C7 | 179.5° | 180.0° |
N5 | C5A | C6 | H6 | 0.5° | 0.1° |
N5 | C5A | C9A | C9 | 179.1° | 180.0° |
N5 | C5A | C9A | N10 | 0.5° | 0.0° |
C5A | C6 | C7 | H6 | 180.0° | 179.9° |
C6 | C5A | C9A | C9 | 0.4° | 0.0° |
C6 | C5A | C9A | N10 | 180.0° | 180.0° |
C5A | C6 | C7 | C7M | 179.6° | 180.0° |
C5A | C6 | C7 | C8 | 0.6° | 0.0° |
C9A | C5A | C6 | C7 | 0.1° | 0.0° |
C9A | C5A | C6 | H6 | 180.0° | 179.9° |
C5A | C9A | C9 | N10 | 179.6° | 180.0° |
C5A | C9A | C9 | C8 | 1.4° | 0.0° |
C5A | C9A | C9 | H9 | 178.6° | 179.9° |
C5A | C9A | N10 | C1' | 179.9° | 180.0° |
C6 | C7 | C7M | C8 | 179.1° | 180.0° |
C6 | C7 | C7M | H7M1 | 180.0° | 90.0° |
C6 | C7 | C7M | H7M2 | 54.7° | 30.0° |
C6 | C7 | C7M | H7M3 | 54.7° | 150.0° |
C6 | C7 | C8 | C8M | 179.3° | 180.0° |
C6 | C7 | C8 | C9 | 1.6° | 0.0° |
H6 | C6 | C7 | C7M | 0.3° | 0.1° |
H6 | C6 | C7 | C8 | 179.4° | 179.9° |
C9A | C9 | C8 | C7 | 2.0° | 0.0° |
C9A | C9 | C8 | C8M | 179.7° | 180.0° |
C9A | C9 | C8 | H9 | 180.0° | 179.9° |
C9 | C9A | N10 | C1' | 0.5° | 0.0° |
N10 | C9A | C9 | C8 | 179.0° | 180.0° |
N10 | C9A | C9 | H9 | 1.0° | 0.0° |
C9A | N10 | C1' | H1'1 | 0.3° | 90.1° |
C9A | N10 | C1' | H1'2 | 125.0° | 150.0° |
C9A | N10 | C1' | H1'3 | 125.5° | 30.0° |
C7 | C7M | H7M1 | H7M2 | 125.3° | 120.0° |
C7 | C7M | H7M1 | H7M3 | 125.3° | 120.0° |
C7 | C7M | H7M2 | H7M3 | 114.2° | 120.1° |
C7M | C7 | C8 | C8M | 1.6° | 0.0° |
C7M | C7 | C8 | C9 | 179.3° | 180.0° |
C8 | C7 | C7M | H7M1 | 0.9° | 90.0° |
C8 | C7 | C7M | H7M2 | 124.3° | 150.0° |
C8 | C7 | C7M | H7M3 | 126.2° | 30.0° |
C7 | C8 | C8M | C9 | 177.7° | 180.0° |
C7 | C8 | C8M | H8M1 | 180.0° | 90.0° |
C7 | C8 | C8M | H8M2 | 54.7° | 30.0° |
C7 | C8 | C8M | H8M3 | 54.8° | 150.0° |
C7 | C8 | C9 | H9 | 178.0° | 179.9° |
H7M1 | C7M | H7M2 | H7M3 | 114.3° | 119.9° |
C8 | C8M | H8M1 | H8M2 | 125.3° | 120.0° |
C8 | C8M | H8M1 | H8M3 | 125.2° | 120.0° |
C8 | C8M | H8M2 | H8M3 | 114.1° | 120.0° |
C8M | C8 | C9 | H9 | 0.3° | 0.1° |
C9 | C8 | C8M | H8M1 | 2.3° | 90.0° |
C9 | C8 | C8M | H8M2 | 127.6° | 150.0° |
C9 | C8 | C8M | H8M3 | 122.9° | 30.0° |
H8M1 | C8M | H8M2 | H8M3 | 114.2° | 120.0° |
N10 | C1' | H1'1 | H1'2 | 125.3° | 119.9° |
N10 | C1' | H1'1 | H1'3 | 125.3° | 120.0° |
N10 | C1' | H1'2 | H1'3 | 114.7° | 120.0° |
H1'1 | C1' | H1'2 | H1'3 | 114.7° | 120.1° |