FNR
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C9A | N10 | sing | 1.40Å | 1.43Å | |
C9A | C5A | doub | 1.40Å | 1.42Å | Aromatic |
C9A | C9 | sing | 1.38Å | 1.41Å | Aromatic |
N10 | CAA | sing | 1.38Å | 1.41Å | |
N10 | C1' | sing | 1.47Å | 1.48Å | |
CAA | N1 | sing | 1.37Å | 1.36Å | |
CAA | C4A | doub | 1.37Å | 1.38Å | |
N1 | C2 | sing | 1.35Å | 1.33Å | |
N1 | HN1 | sing | 0.97Å | 1.00Å | |
C2 | O2 | doub | 1.22Å | 1.23Å | |
C2 | N3 | sing | 1.35Å | 1.37Å | |
N3 | C4 | sing | 1.35Å | 1.41Å | |
N3 | H3 | sing | 0.97Å | 1.00Å | |
C4 | O4 | doub | 1.22Å | 1.21Å | |
C4 | C4A | sing | 1.40Å | 1.42Å | |
C4A | N5 | sing | 1.42Å | 1.42Å | |
N5 | C5A | sing | 1.40Å | 1.41Å | |
N5 | H5 | sing | 0.97Å | 1.00Å | |
C5A | C6 | sing | 1.38Å | 1.40Å | Aromatic |
C6 | C7 | doub | 1.38Å | 1.40Å | Aromatic |
C6 | H7 | sing | 1.08Å | 1.08Å | |
C7 | C7M | sing | 1.51Å | 1.54Å | |
C7 | C8 | sing | 1.38Å | 1.42Å | Aromatic |
C7M | H7M1 | sing | 1.09Å | 1.10Å | |
C7M | H7M2 | sing | 1.09Å | 1.10Å | |
C7M | H7M3 | sing | 1.09Å | 1.10Å | |
C8 | C8M | sing | 1.51Å | 1.54Å | |
C8 | C9 | doub | 1.38Å | 1.40Å | Aromatic |
C8M | H8M1 | sing | 1.09Å | 1.10Å | |
C8M | H8M2 | sing | 1.09Å | 1.10Å | |
C8M | H8M3 | sing | 1.09Å | 1.10Å | |
C9 | H9 | sing | 1.08Å | 1.08Å | |
C1' | C2' | sing | 1.53Å | 1.53Å | |
C1' | H1'1 | sing | 1.09Å | 1.10Å | |
C1' | H1'2 | sing | 1.09Å | 1.10Å | |
C2' | O2' | sing | 1.43Å | 1.44Å | |
C2' | C3' | sing | 1.53Å | 1.52Å | |
C2' | H6 | sing | 1.09Å | 1.10Å | |
O2' | H2' | sing | 0.97Å | 0.95Å | |
C3' | O3' | sing | 1.43Å | 1.44Å | |
C3' | C4' | sing | 1.53Å | 1.54Å | |
C3' | H4 | sing | 1.09Å | 1.10Å | |
O3' | H3' | sing | 0.97Å | 0.95Å | |
C4' | O4' | sing | 1.43Å | 1.43Å | |
C4' | C5' | sing | 1.53Å | 1.53Å | |
C4' | H2 | sing | 1.09Å | 1.10Å | |
O4' | H4' | sing | 0.97Å | 0.95Å | |
C5' | O5' | sing | 1.43Å | 1.43Å | |
C5' | H5'1 | sing | 1.09Å | 1.10Å | |
C5' | H5'2 | sing | 1.09Å | 1.10Å | |
O5' | P | sing | 1.61Å | 1.59Å | |
P | O1P | sing | 1.61Å | 1.59Å | |
P | O2P | doub | 1.48Å | 1.47Å | |
P | O3P | sing | 1.61Å | 1.49Å | |
O1P | H1 | sing | 0.97Å | 0.95Å | |
O3P | H3P | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N10 | C9A | C5A | 118.5° | 119.5° |
N10 | C9A | C9 | 122.3° | 120.6° |
C9A | N10 | CAA | 120.0° | 119.7° |
C9A | N10 | C1' | 121.4° | 120.2° |
C5A | C9A | C9 | 119.2° | 119.9° |
C9A | C5A | N5 | 121.0° | 119.1° |
C9A | C5A | C6 | 121.9° | 120.0° |
C9A | C9 | C8 | 119.4° | 119.8° |
C9A | C9 | H9 | 120.3° | 120.1° |
CAA | N10 | C1' | 118.5° | 120.1° |
N10 | CAA | N1 | 118.6° | 120.5° |
N10 | CAA | C4A | 120.5° | 120.2° |
N10 | C1' | C2' | 113.0° | 109.5° |
N10 | C1' | H1'1 | 108.5° | 109.4° |
N10 | C1' | H1'2 | 108.5° | 109.5° |
N1 | CAA | C4A | 120.9° | 119.3° |
CAA | N1 | C2 | 121.0° | 120.2° |
CAA | N1 | HN1 | 119.5° | 119.9° |
CAA | C4A | C4 | 118.7° | 119.3° |
CAA | C4A | N5 | 121.0° | 120.0° |
C2 | N1 | HN1 | 119.5° | 119.9° |
N1 | C2 | O2 | 119.1° | 119.4° |
N1 | C2 | N3 | 121.6° | 121.2° |
O2 | C2 | N3 | 119.3° | 119.4° |
C2 | N3 | C4 | 119.8° | 120.6° |
C2 | N3 | H3 | 120.1° | 119.6° |
C4 | N3 | H3 | 120.1° | 119.7° |
N3 | C4 | O4 | 120.2° | 120.4° |
N3 | C4 | C4A | 118.0° | 119.4° |
O4 | C4 | C4A | 121.8° | 120.3° |
C4 | C4A | N5 | 120.3° | 120.7° |
C4A | N5 | C5A | 119.0° | 118.7° |
C4A | N5 | H5 | 120.5° | 120.6° |
C5A | N5 | H5 | 120.5° | 120.7° |
N5 | C5A | C6 | 117.1° | 120.9° |
C5A | C6 | C7 | 118.5° | 119.8° |
C5A | C6 | H7 | 120.7° | 120.1° |
C7 | C6 | H7 | 120.8° | 120.1° |
C6 | C7 | C7M | 115.8° | 119.9° |
C6 | C7 | C8 | 120.5° | 120.2° |
C7M | C7 | C8 | 123.8° | 119.9° |
C7 | C7M | H7M1 | 109.5° | 109.5° |
C7 | C7M | H7M2 | 109.5° | 109.5° |
C7 | C7M | H7M3 | 109.5° | 109.5° |
C7 | C8 | C8M | 123.6° | 119.8° |
C7 | C8 | C9 | 120.5° | 120.3° |
H7M1 | C7M | H7M2 | 109.5° | 109.5° |
H7M1 | C7M | H7M3 | 109.4° | 109.5° |
H7M2 | C7M | H7M3 | 109.5° | 109.4° |
C8M | C8 | C9 | 115.9° | 119.9° |
C8 | C8M | H8M1 | 109.5° | 109.5° |
C8 | C8M | H8M2 | 109.5° | 109.5° |
C8 | C8M | H8M3 | 109.5° | 109.5° |
C8 | C9 | H9 | 120.3° | 120.1° |
H8M1 | C8M | H8M2 | 109.5° | 109.4° |
H8M1 | C8M | H8M3 | 109.4° | 109.5° |
H8M2 | C8M | H8M3 | 109.5° | 109.5° |
C2' | C1' | H1'1 | 108.6° | 109.4° |
C2' | C1' | H1'2 | 108.6° | 109.5° |
C1' | C2' | O2' | 111.0° | 109.4° |
C1' | C2' | C3' | 109.8° | 109.5° |
C1' | C2' | H6 | 108.0° | 109.5° |
H1'1 | C1' | H1'2 | 109.5° | 109.5° |
O2' | C2' | C3' | 110.8° | 109.5° |
O2' | C2' | H6 | 109.2° | 109.5° |
C2' | O2' | H2' | 109.5° | 114.0° |
C3' | C2' | H6 | 108.0° | 109.5° |
C2' | C3' | O3' | 110.6° | 109.4° |
C2' | C3' | C4' | 111.4° | 109.5° |
C2' | C3' | H4 | 107.8° | 109.5° |
O3' | C3' | C4' | 110.6° | 109.5° |
O3' | C3' | H4 | 108.8° | 109.4° |
C3' | O3' | H3' | 109.5° | 114.0° |
C4' | C3' | H4 | 107.6° | 109.5° |
C3' | C4' | O4' | 108.2° | 109.5° |
C3' | C4' | C5' | 113.5° | 109.5° |
C3' | C4' | H2 | 107.7° | 109.4° |
O4' | C4' | C5' | 110.4° | 109.5° |
O4' | C4' | H2 | 109.1° | 109.5° |
C4' | O4' | H4' | 109.5° | 114.0° |
C5' | C4' | H2 | 107.8° | 109.5° |
C4' | C5' | O5' | 110.1° | 109.5° |
C4' | C5' | H5'1 | 109.3° | 109.5° |
C4' | C5' | H5'2 | 109.3° | 109.5° |
O5' | C5' | H5'1 | 109.3° | 109.5° |
O5' | C5' | H5'2 | 109.3° | 109.5° |
C5' | O5' | P | 119.3° | 123.0° |
H5'1 | C5' | H5'2 | 109.5° | 109.4° |
O5' | P | O1P | 99.2° | 109.5° |
O5' | P | O2P | 108.1° | 109.5° |
O5' | P | O3P | 108.8° | 109.5° |
O1P | P | O2P | 110.5° | 109.5° |
O1P | P | O3P | 108.6° | 109.4° |
P | O1P | H1 | 109.5° | 114.0° |
O2P | P | O3P | 119.6° | 109.5° |
P | O3P | H3P | 109.5° | 114.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N10 | C9A | C5A | C9 | 179.5° | 179.7° |
C9A | N10 | CAA | C1' | 175.8° | 179.9° |
C9A | N10 | CAA | N1 | 179.1° | 166.3° |
C9A | N10 | CAA | C4A | 2.7° | 13.7° |
N10 | C9A | C5A | N5 | 1.5° | 0.0° |
N10 | C9A | C5A | C6 | 178.7° | 179.9° |
N10 | C9A | C9 | C8 | 179.1° | 179.8° |
N10 | C9A | C9 | H9 | 0.9° | 0.1° |
C9A | N10 | C1' | C2' | 82.3° | 84.5° |
C9A | N10 | C1' | H1'1 | 38.2° | 35.4° |
C9A | N10 | C1' | H1'2 | 157.2° | 155.5° |
C5A | C9A | N10 | CAA | 0.9° | 13.6° |
C5A | C9A | N10 | C1' | 174.9° | 166.3° |
C9A | C5A | N5 | C4A | 2.1° | 13.2° |
C9A | C5A | N5 | C6 | 179.8° | 180.0° |
C9A | C5A | N5 | H5 | 177.9° | 166.8° |
C9A | C5A | C6 | C7 | 0.7° | 0.1° |
C9A | C5A | C6 | H7 | 179.3° | 180.0° |
C5A | C9A | C9 | C8 | 0.4° | 0.5° |
C5A | C9A | C9 | H9 | 179.6° | 179.7° |
C9 | C9A | N10 | CAA | 178.6° | 166.1° |
C9 | C9A | N10 | C1' | 5.6° | 14.0° |
C9 | C9A | C5A | N5 | 178.9° | 179.7° |
C9 | C9A | C5A | C6 | 0.8° | 0.3° |
C9A | C9 | C8 | C7 | 0.0° | 0.5° |
C9A | C9 | C8 | C8M | 179.1° | 179.8° |
C9A | C9 | C8 | H9 | 180.0° | 179.8° |
N10 | CAA | N1 | C4A | 178.2° | 179.9° |
N10 | CAA | N1 | C2 | 177.5° | 180.0° |
N10 | CAA | N1 | HN1 | 2.5° | 0.0° |
N10 | CAA | C4A | C4 | 177.7° | 179.9° |
N10 | CAA | C4A | N5 | 2.1° | 0.2° |
CAA | N10 | C1' | C2' | 93.5° | 95.4° |
CAA | N10 | C1' | H1'1 | 146.0° | 144.7° |
CAA | N10 | C1' | H1'2 | 27.0° | 24.7° |
C1' | N10 | CAA | N1 | 5.1° | 13.9° |
C1' | N10 | CAA | C4A | 173.1° | 166.2° |
N10 | C1' | C2' | H1'1 | 120.5° | 119.9° |
N10 | C1' | C2' | H1'2 | 120.5° | 120.0° |
N10 | C1' | H1'1 | H1'2 | 118.3° | 120.0° |
N10 | C1' | C2' | O2' | 61.6° | 65.2° |
N10 | C1' | C2' | C3' | 175.5° | 174.8° |
N10 | C1' | C2' | H6 | 58.0° | 54.8° |
CAA | N1 | C2 | HN1 | 180.0° | 180.0° |
CAA | N1 | C2 | O2 | 179.2° | 180.0° |
CAA | N1 | C2 | N3 | 0.7° | 0.0° |
N1 | CAA | C4A | C4 | 0.5° | 0.1° |
N1 | CAA | C4A | N5 | 179.7° | 179.8° |
C4A | CAA | N1 | C2 | 0.7° | 0.1° |
C4A | CAA | N1 | HN1 | 179.3° | 179.9° |
CAA | C4A | C4 | N3 | 0.1° | 0.1° |
CAA | C4A | C4 | O4 | 175.9° | 180.0° |
CAA | C4A | C4 | N5 | 179.9° | 179.9° |
CAA | C4A | N5 | C5A | 0.3° | 13.3° |
CAA | C4A | N5 | H5 | 179.7° | 166.7° |
N1 | C2 | O2 | N3 | 178.6° | 180.0° |
N1 | C2 | N3 | C4 | 0.4° | 0.0° |
N1 | C2 | N3 | H3 | 179.6° | 180.0° |
HN1 | N1 | C2 | O2 | 0.8° | 0.0° |
HN1 | N1 | C2 | N3 | 179.3° | 180.0° |
O2 | C2 | N3 | C4 | 178.9° | 180.0° |
O2 | C2 | N3 | H3 | 1.1° | 0.1° |
C2 | N3 | C4 | H3 | 180.0° | 179.9° |
C2 | N3 | C4 | O4 | 176.0° | 180.0° |
C2 | N3 | C4 | C4A | 0.1° | 0.0° |
N3 | C4 | O4 | C4A | 175.9° | 180.0° |
N3 | C4 | C4A | N5 | 180.0° | 179.8° |
H3 | N3 | C4 | O4 | 4.0° | 0.1° |
H3 | N3 | C4 | C4A | 179.9° | 180.0° |
O4 | C4 | C4A | N5 | 4.0° | 0.2° |
C4 | C4A | N5 | C5A | 179.9° | 166.5° |
C4 | C4A | N5 | H5 | 0.1° | 13.4° |
C4A | N5 | C5A | H5 | 180.0° | 180.0° |
C4A | N5 | C5A | C6 | 178.1° | 166.7° |
N5 | C5A | C6 | C7 | 179.1° | 179.9° |
N5 | C5A | C6 | H7 | 1.0° | 0.1° |
H5 | N5 | C5A | C6 | 1.9° | 13.2° |
C5A | C6 | C7 | H7 | 180.0° | 180.0° |
C5A | C6 | C7 | C7M | 179.6° | 180.0° |
C5A | C6 | C7 | C8 | 0.2° | 0.0° |
C6 | C7 | C7M | C8 | 179.8° | 180.0° |
C6 | C7 | C7M | H7M1 | 90.0° | 90.0° |
C6 | C7 | C7M | H7M2 | 149.9° | 149.9° |
C6 | C7 | C7M | H7M3 | 29.9° | 30.0° |
C6 | C7 | C8 | C8M | 179.1° | 180.0° |
C6 | C7 | C8 | C9 | 0.1° | 0.3° |
H7 | C6 | C7 | C7M | 0.4° | 0.0° |
H7 | C6 | C7 | C8 | 179.7° | 180.0° |
C7 | C7M | H7M1 | H7M2 | 120.0° | 120.0° |
C7 | C7M | H7M1 | H7M3 | 120.0° | 120.0° |
C7 | C7M | H7M2 | H7M3 | 120.0° | 120.0° |
C7M | C7 | C8 | C8M | 1.0° | 0.0° |
C7M | C7 | C8 | C9 | 179.9° | 179.8° |
C8 | C7 | C7M | H7M1 | 90.1° | 90.0° |
C8 | C7 | C7M | H7M2 | 29.9° | 30.0° |
C8 | C7 | C7M | H7M3 | 149.9° | 150.0° |
C7 | C8 | C8M | C9 | 179.1° | 179.8° |
C7 | C8 | C8M | H8M1 | 89.5° | 90.0° |
C7 | C8 | C8M | H8M2 | 150.5° | 150.0° |
C7 | C8 | C8M | H8M3 | 30.5° | 30.0° |
C7 | C8 | C9 | H9 | 180.0° | 179.7° |
H7M1 | C7M | H7M2 | H7M3 | 120.0° | 120.0° |
C8 | C8M | H8M1 | H8M2 | 120.0° | 120.0° |
C8 | C8M | H8M1 | H8M3 | 120.0° | 120.1° |
C8 | C8M | H8M2 | H8M3 | 120.0° | 120.0° |
C8M | C8 | C9 | H9 | 0.9° | 0.0° |
C9 | C8 | C8M | H8M1 | 89.6° | 89.7° |
C9 | C8 | C8M | H8M2 | 30.4° | 30.2° |
C9 | C8 | C8M | H8M3 | 150.4° | 150.2° |
H8M1 | C8M | H8M2 | H8M3 | 119.9° | 120.0° |
C2' | C1' | H1'1 | H1'2 | 118.4° | 120.1° |
C1' | C2' | O2' | C3' | 122.2° | 120.0° |
C1' | C2' | O2' | H6 | 118.9° | 120.0° |
C1' | C2' | C3' | H6 | 117.5° | 120.0° |
C1' | C2' | O2' | H2' | 180.0° | 57.6° |
C1' | C2' | C3' | O3' | 45.8° | 60.0° |
C1' | C2' | C3' | C4' | 169.3° | 180.0° |
C1' | C2' | C3' | H4 | 72.9° | 59.9° |
H1'1 | C1' | C2' | O2' | 177.8° | 174.9° |
H1'1 | C1' | C2' | C3' | 55.0° | 54.9° |
H1'1 | C1' | C2' | H6 | 62.5° | 65.1° |
H1'2 | C1' | C2' | O2' | 58.9° | 54.8° |
H1'2 | C1' | C2' | C3' | 64.0° | 65.2° |
H1'2 | C1' | C2' | H6 | 178.5° | 174.8° |
O2' | C2' | C3' | H6 | 119.6° | 120.0° |
O2' | C2' | C3' | O3' | 168.8° | 180.0° |
O2' | C2' | C3' | C4' | 67.8° | 60.0° |
O2' | C2' | C3' | H4 | 50.0° | 60.0° |
C3' | C2' | O2' | H2' | 57.8° | 62.4° |
C2' | C3' | O3' | C4' | 123.9° | 120.0° |
C2' | C3' | O3' | H4 | 118.2° | 120.0° |
C2' | C3' | C4' | H4 | 117.9° | 120.0° |
C2' | C3' | O3' | H3' | 180.0° | 60.0° |
C2' | C3' | C4' | O4' | 161.0° | 60.0° |
C2' | C3' | C4' | C5' | 76.1° | 180.0° |
C2' | C3' | C4' | H2 | 43.2° | 60.0° |
H6 | C2' | O2' | H2' | 61.1° | 177.6° |
H6 | C2' | C3' | O3' | 71.6° | 60.0° |
H6 | C2' | C3' | C4' | 51.8° | 60.0° |
H6 | C2' | C3' | H4 | 169.6° | 180.0° |
O3' | C3' | C4' | H4 | 118.7° | 120.0° |
O3' | C3' | C4' | O4' | 75.5° | NaN° |
O3' | C3' | C4' | C5' | 47.3° | 60.0° |
O3' | C3' | C4' | H2 | 166.6° | 60.0° |
C4' | C3' | O3' | H3' | 56.1° | 60.0° |
C3' | C4' | O4' | C5' | 124.7° | 120.0° |
C3' | C4' | O4' | H2 | 117.0° | 120.0° |
C3' | C4' | C5' | H2 | 119.3° | 120.0° |
C3' | C4' | O4' | H4' | 180.0° | 60.0° |
C3' | C4' | C5' | O5' | 78.4° | 175.0° |
C3' | C4' | C5' | H5'1 | 41.6° | 55.0° |
C3' | C4' | C5' | H5'2 | 161.5° | 65.0° |
H4 | C3' | O3' | H3' | 61.8° | 180.0° |
H4 | C3' | C4' | O4' | 43.1° | 60.0° |
H4 | C3' | C4' | C5' | 166.0° | 60.0° |
H4 | C3' | C4' | H2 | 74.7° | 180.0° |
O4' | C4' | C5' | H2 | 119.1° | 120.0° |
O4' | C4' | C5' | O5' | 159.9° | 65.0° |
O4' | C4' | C5' | H5'1 | 80.0° | 175.0° |
O4' | C4' | C5' | H5'2 | 39.9° | 55.0° |
C5' | C4' | O4' | H4' | 55.3° | 60.0° |
C4' | C5' | O5' | H5'1 | 120.1° | 120.1° |
C4' | C5' | O5' | H5'2 | 120.1° | 120.0° |
C4' | C5' | H5'1 | H5'2 | 119.8° | 120.0° |
C4' | C5' | O5' | P | 175.1° | 180.0° |
H2 | C4' | O4' | H4' | 63.0° | 180.0° |
H2 | C4' | C5' | O5' | 40.8° | 55.0° |
H2 | C4' | C5' | H5'1 | 160.9° | 65.0° |
H2 | C4' | C5' | H5'2 | 79.2° | 175.0° |
O5' | C5' | H5'1 | H5'2 | 119.7° | 120.0° |
C5' | O5' | P | O1P | 65.7° | 65.0° |
C5' | O5' | P | O2P | 179.1° | 55.0° |
C5' | O5' | P | O3P | 47.7° | 175.0° |
H5'1 | C5' | O5' | P | 64.8° | 60.0° |
H5'2 | C5' | O5' | P | 55.0° | 60.0° |
O5' | P | O1P | O2P | 113.4° | 120.0° |
O5' | P | O1P | O3P | 113.5° | 120.0° |
O5' | P | O2P | O3P | 125.1° | 120.0° |
O5' | P | O1P | H1 | 113.4° | 60.0° |
O5' | P | O3P | H3P | 124.8° | 180.0° |
O1P | P | O2P | O3P | 127.2° | 120.0° |
O1P | P | O3P | H3P | 128.1° | 60.0° |
O2P | P | O1P | H1 | 0.0° | 180.0° |
O2P | P | O3P | H3P | 0.0° | 59.9° |
O3P | P | O1P | H1 | 133.0° | 60.0° |