LCC
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O5' | C5' | sing | 1.43Å | 1.42Å | |
O5' | P | sing | 1.61Å | 1.61Å | |
C5' | C4' | sing | 1.53Å | 1.53Å | |
C5' | H5'1 | sing | 1.09Å | 1.09Å | |
C5' | H5'2 | sing | 1.09Å | 1.09Å | |
C4' | O4' | sing | 1.46Å | 1.43Å | |
C4' | C3' | sing | 1.57Å | 1.53Å | |
C4' | C6' | sing | 1.56Å | 1.54Å | |
O4' | C1' | sing | 1.44Å | 1.43Å | |
C1' | N1 | sing | 1.46Å | 1.50Å | |
C1' | C2' | sing | 1.56Å | 1.54Å | |
C1' | H1' | sing | 1.09Å | 1.09Å | |
N1 | C6 | sing | 1.36Å | 1.38Å | |
N1 | C2 | sing | 1.35Å | 1.40Å | |
C6 | C5 | doub | 1.35Å | 1.36Å | |
C6 | H6 | sing | 1.08Å | 1.08Å | |
C5 | C5M | sing | 1.51Å | 1.52Å | |
C5 | C4 | sing | 1.41Å | 1.44Å | |
C5M | H5M1 | sing | 1.09Å | 1.09Å | |
C5M | H5M2 | sing | 1.09Å | 1.09Å | |
C5M | H5M3 | sing | 1.09Å | 1.09Å | |
C4 | N4 | sing | 1.38Å | 1.34Å | |
C4 | N3 | doub | 1.33Å | 1.34Å | |
N4 | H41 | sing | 0.97Å | 1.01Å | |
N4 | H42 | sing | 0.97Å | 1.01Å | |
N3 | C2 | sing | 1.33Å | 1.36Å | |
C2 | O2 | doub | 1.22Å | 1.23Å | |
C3' | C2' | sing | 1.57Å | 1.52Å | |
C3' | O3' | sing | 1.43Å | 1.42Å | |
C3' | H3' | sing | 1.09Å | 1.09Å | |
C2' | O2' | sing | 1.46Å | 1.43Å | |
C2' | H2'1 | sing | 1.09Å | 1.09Å | |
O2' | C6' | sing | 1.44Å | 1.43Å | |
O3' | H3T | sing | 0.97Å | 0.96Å | |
C6' | H6'1 | sing | 1.09Å | 1.09Å | |
C6' | H6'2 | sing | 1.09Å | 1.09Å | |
P | O1P | sing | 1.61Å | 1.48Å | |
P | O2P | doub | 1.48Å | 1.48Å | |
P | OXT | sing | 1.61Å | 1.61Å | |
O1P | H1P | sing | 0.97Å | 0.95Å | |
OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C5' | O5' | P | 122.7° | 106.8° |
O5' | C5' | C4' | 107.7° | 109.5° |
O5' | C5' | H5'1 | 110.4° | 109.5° |
O5' | C5' | H5'2 | 109.8° | 109.4° |
O5' | P | O1P | 108.2° | 109.5° |
O5' | P | O2P | 107.5° | 109.4° |
O5' | P | OXT | 104.2° | 109.4° |
C4' | C5' | H5'1 | 110.0° | 109.5° |
C4' | C5' | H5'2 | 109.6° | 109.4° |
C5' | C4' | O4' | 112.5° | 116.3° |
C5' | C4' | C3' | 114.7° | 117.3° |
C5' | C4' | C6' | 116.0° | 116.5° |
H5'1 | C5' | H5'2 | 109.4° | 109.5° |
O4' | C4' | C3' | 104.7° | 101.2° |
O4' | C4' | C6' | 107.4° | 103.9° |
C4' | O4' | C1' | 106.4° | 106.9° |
C3' | C4' | C6' | 100.3° | 99.0° |
C4' | C3' | C2' | 88.5° | 93.1° |
C4' | C3' | O3' | 117.0° | 112.7° |
C4' | C3' | H3' | 112.4° | 112.6° |
C4' | C6' | O2' | 101.4° | 105.4° |
C4' | C6' | H6'1 | 112.7° | 110.3° |
C4' | C6' | H6'2 | 110.2° | 110.3° |
O4' | C1' | N1 | 113.0° | 110.3° |
O4' | C1' | C2' | 100.7° | 105.4° |
O4' | C1' | H1' | 111.9° | 110.3° |
N1 | C1' | C2' | 113.1° | 110.3° |
N1 | C1' | H1' | 107.8° | 110.2° |
C1' | N1 | C6 | 121.7° | 119.8° |
C1' | N1 | C2 | 118.1° | 119.9° |
C2' | C1' | H1' | 110.2° | 110.2° |
C1' | C2' | C3' | 101.0° | 98.9° |
C1' | C2' | O2' | 107.7° | 103.9° |
C1' | C2' | H2'1 | 113.3° | 117.2° |
C6 | N1 | C2 | 120.1° | 120.3° |
N1 | C6 | C5 | 121.5° | 119.3° |
N1 | C6 | H6 | 119.4° | 120.3° |
N1 | C2 | N3 | 118.9° | 121.2° |
N1 | C2 | O2 | 121.3° | 119.4° |
C5 | C6 | H6 | 119.1° | 120.4° |
C6 | C5 | C5M | 120.6° | 120.5° |
C6 | C5 | C4 | 117.2° | 118.9° |
C5M | C5 | C4 | 122.2° | 120.5° |
C5 | C5M | H5M1 | 110.0° | 109.5° |
C5 | C5M | H5M2 | 110.4° | 109.5° |
C5 | C5M | H5M3 | 109.5° | 109.4° |
C5 | C4 | N4 | 121.7° | 120.2° |
C5 | C4 | N3 | 120.9° | 119.6° |
H5M1 | C5M | H5M2 | 108.5° | 109.4° |
H5M1 | C5M | H5M3 | 109.3° | 109.5° |
H5M2 | C5M | H5M3 | 109.1° | 109.5° |
N4 | C4 | N3 | 117.5° | 120.2° |
C4 | N4 | H41 | 119.1° | 120.0° |
C4 | N4 | H42 | 120.1° | 120.0° |
C4 | N3 | C2 | 121.4° | 120.7° |
H41 | N4 | H42 | 120.7° | 120.0° |
N3 | C2 | O2 | 119.9° | 119.4° |
C2' | C3' | O3' | 114.4° | 112.5° |
C2' | C3' | H3' | 112.9° | 112.5° |
C3' | C2' | O2' | 105.2° | 101.1° |
C3' | C2' | H2'1 | 114.2° | 116.7° |
O3' | C3' | H3' | 110.2° | 112.1° |
C3' | O3' | H3T | 108.4° | 106.9° |
O2' | C2' | H2'1 | 114.3° | 116.3° |
C2' | O2' | C6' | 105.6° | 107.0° |
O2' | C6' | H6'1 | 113.5° | 110.3° |
O2' | C6' | H6'2 | 109.6° | 110.3° |
H6'1 | C6' | H6'2 | 109.1° | 110.2° |
O1P | P | O2P | 119.6° | 109.5° |
O1P | P | OXT | 108.2° | 109.4° |
P | O1P | H1P | 108.1° | 106.8° |
O2P | P | OXT | 108.2° | 109.5° |
P | OXT | HXT | 104.3° | 106.8° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O5' | C5' | C4' | H5'1 | 120.3° | 120.1° |
O5' | C5' | C4' | H5'2 | 119.4° | 119.9° |
O5' | C5' | H5'1 | H5'2 | 120.8° | 119.9° |
O5' | C5' | C4' | O4' | 63.4° | 61.2° |
O5' | C5' | C4' | C3' | 56.1° | 178.9° |
O5' | C5' | C4' | C6' | 172.4° | 61.9° |
C5' | O5' | P | O1P | 43.3° | 180.0° |
C5' | O5' | P | O2P | 173.7° | 60.0° |
C5' | O5' | P | OXT | 71.6° | 60.1° |
P | O5' | C5' | C4' | 176.6° | 180.0° |
P | O5' | C5' | H5'1 | 63.3° | 60.0° |
P | O5' | C5' | H5'2 | 57.3° | 60.0° |
O5' | P | O1P | O2P | 123.3° | 120.0° |
O5' | P | O1P | OXT | 112.3° | 120.0° |
O5' | P | O2P | OXT | 112.0° | 120.0° |
O5' | P | O1P | H1P | 180.0° | 179.9° |
O5' | P | OXT | HXT | 180.0° | 60.0° |
C4' | C5' | H5'1 | H5'2 | 120.4° | 120.0° |
C5' | C4' | O4' | C3' | 125.2° | 128.3° |
C5' | C4' | O4' | C6' | 128.8° | 129.4° |
C5' | C4' | C3' | C6' | 125.0° | 126.2° |
C5' | C4' | O4' | C1' | 157.0° | 166.1° |
C5' | C4' | C3' | C2' | 178.2° | 177.3° |
C5' | C4' | C3' | O3' | 65.0° | 61.3° |
C5' | C4' | C3' | H3' | 64.0° | 66.7° |
C5' | C4' | C6' | O2' | 166.9° | 158.9° |
C5' | C4' | C6' | H6'1 | 71.3° | 39.9° |
C5' | C4' | C6' | H6'2 | 50.8° | 82.1° |
H5'1 | C5' | C4' | O4' | 56.9° | 58.9° |
H5'1 | C5' | C4' | C3' | 176.5° | 61.0° |
H5'1 | C5' | C4' | C6' | 67.3° | 178.0° |
H5'2 | C5' | C4' | O4' | 177.2° | 179.0° |
H5'2 | C5' | C4' | C3' | 63.3° | 59.1° |
H5'2 | C5' | C4' | C6' | 53.0° | 58.0° |
O4' | C4' | C3' | C6' | 111.2° | 106.2° |
C4' | O4' | C1' | N1 | 114.3° | 122.3° |
C4' | O4' | C1' | C2' | 6.6° | 3.3° |
C4' | O4' | C1' | H1' | 123.7° | 115.7° |
O4' | C4' | C3' | C2' | 54.4° | 55.1° |
O4' | C4' | C3' | O3' | 171.2° | 171.2° |
O4' | C4' | C3' | H3' | 59.8° | 60.9° |
O4' | C4' | C6' | O2' | 66.3° | 71.8° |
O4' | C4' | C6' | H6'1 | 55.4° | 169.1° |
O4' | C4' | C6' | H6'2 | 177.6° | 47.2° |
C3' | C4' | O4' | C1' | 31.8° | 37.9° |
C4' | C3' | C2' | C1' | 57.0° | 51.1° |
C4' | C3' | C2' | O3' | 119.1° | 116.2° |
C4' | C3' | C2' | H3' | 113.7° | 116.0° |
C4' | C3' | O3' | H3' | 130.0° | 128.2° |
C4' | C3' | C2' | O2' | 54.9° | 55.1° |
C4' | C3' | C2' | H2'1 | 178.9° | 177.7° |
C3' | C4' | C6' | O2' | 42.8° | 32.2° |
C4' | C3' | O3' | H3T | 72.1° | 165.2° |
C3' | C4' | C6' | H6'1 | 164.6° | 86.9° |
C3' | C4' | C6' | H6'2 | 73.3° | 151.2° |
C6' | C4' | O4' | C1' | 74.2° | 64.5° |
C6' | C4' | C3' | C2' | 56.8° | 51.1° |
C6' | C4' | C3' | O3' | 60.0° | 64.9° |
C6' | C4' | C3' | H3' | 171.1° | 167.1° |
C4' | C6' | O2' | C2' | 6.8° | 3.4° |
C4' | C6' | O2' | H6'1 | 121.2° | 119.1° |
C4' | C6' | O2' | H6'2 | 116.5° | 119.0° |
C4' | C6' | H6'1 | H6'2 | 122.8° | 122.0° |
O4' | C1' | N1 | C2' | 113.6° | 116.0° |
O4' | C1' | N1 | H1' | 124.3° | 122.0° |
O4' | C1' | C2' | H1' | 118.3° | 119.0° |
O4' | C1' | N1 | C6 | 16.7° | 21.4° |
O4' | C1' | N1 | C2 | 162.7° | 158.6° |
O4' | C1' | C2' | C3' | 42.9° | 32.1° |
O4' | C1' | C2' | O2' | 67.1° | 71.7° |
O4' | C1' | C2' | H2'1 | 165.4° | 158.4° |
N1 | C1' | C2' | H1' | 120.8° | 122.0° |
C1' | N1 | C6 | C2 | 179.4° | 180.0° |
C1' | N1 | C6 | C5 | 179.6° | 180.0° |
C1' | N1 | C6 | H6 | 0.4° | 0.1° |
C1' | N1 | C2 | N3 | 179.9° | 180.0° |
C1' | N1 | C2 | O2 | 0.2° | 0.0° |
N1 | C1' | C2' | C3' | 78.0° | 86.9° |
N1 | C1' | C2' | O2' | 172.0° | 169.3° |
N1 | C1' | C2' | H2'1 | 44.5° | 39.4° |
C2' | C1' | N1 | C6 | 96.9° | 94.6° |
C2' | C1' | N1 | C2 | 83.7° | 85.4° |
C1' | C2' | C3' | O2' | 111.9° | 106.2° |
C1' | C2' | C3' | H2'1 | 121.9° | 126.6° |
C1' | C2' | C3' | O3' | 176.1° | 167.2° |
C1' | C2' | C3' | H3' | 56.8° | 65.0° |
C1' | C2' | O2' | H2'1 | 126.8° | 130.4° |
C1' | C2' | O2' | C6' | 74.9° | 64.4° |
H1' | C1' | N1 | C6 | 141.0° | 143.4° |
H1' | C1' | N1 | C2 | 38.4° | 36.6° |
H1' | C1' | C2' | C3' | 161.2° | 151.1° |
H1' | C1' | C2' | O2' | 51.2° | 47.3° |
H1' | C1' | C2' | H2'1 | 76.2° | 82.6° |
N1 | C6 | C5 | H6 | 179.2° | 179.9° |
N1 | C6 | C5 | C5M | 179.2° | 180.0° |
N1 | C6 | C5 | C4 | 0.8° | 0.3° |
C6 | N1 | C2 | N3 | 0.7° | 0.0° |
C6 | N1 | C2 | O2 | 179.6° | 179.9° |
C2 | N1 | C6 | C5 | 1.1° | 0.0° |
C2 | N1 | C6 | H6 | 179.7° | 179.9° |
N1 | C2 | N3 | C4 | 0.1° | 0.4° |
N1 | C2 | N3 | O2 | 179.7° | 180.0° |
C6 | C5 | C5M | C4 | 180.0° | 179.6° |
C6 | C5 | C5M | H5M1 | 131.2° | 180.0° |
C6 | C5 | C5M | H5M2 | 11.5° | 60.0° |
C6 | C5 | C5M | H5M3 | 108.6° | 60.0° |
C6 | C5 | C4 | N4 | 179.5° | 180.0° |
C6 | C5 | C4 | N3 | 0.2° | 0.7° |
H6 | C6 | C5 | C5M | 0.0° | 0.1° |
H6 | C6 | C5 | C4 | 180.0° | 179.8° |
C5 | C5M | H5M1 | H5M2 | 120.8° | 120.0° |
C5 | C5M | H5M1 | H5M3 | 120.3° | 120.0° |
C5 | C5M | H5M2 | H5M3 | 120.4° | 120.0° |
C5M | C5 | C4 | N4 | 0.5° | 0.3° |
C5M | C5 | C4 | N3 | 179.8° | 179.7° |
C4 | C5 | C5M | H5M1 | 48.8° | 0.3° |
C4 | C5 | C5M | H5M2 | 168.5° | 119.7° |
C4 | C5 | C5M | H5M3 | 71.4° | 120.3° |
C5 | C4 | N4 | N3 | 179.7° | 179.3° |
C5 | C4 | N4 | H41 | 178.6° | 179.4° |
C5 | C4 | N4 | H42 | 1.1° | 0.6° |
C5 | C4 | N3 | C2 | 0.2° | 0.7° |
H5M1 | C5M | H5M2 | H5M3 | 119.0° | 120.0° |
C4 | N4 | H41 | H42 | 177.5° | 180.0° |
N4 | C4 | N3 | C2 | 179.8° | 180.0° |
N3 | C4 | N4 | H41 | 1.0° | 0.1° |
N3 | C4 | N4 | H42 | 178.5° | 179.9° |
C4 | N3 | C2 | O2 | 179.8° | 179.6° |
C2' | C3' | O3' | H3' | 128.5° | 128.0° |
C3' | C2' | O2' | H2'1 | 126.1° | 127.4° |
C3' | C2' | O2' | C6' | 32.1° | 37.8° |
C2' | C3' | O3' | H3T | 173.6° | 61.4° |
O3' | C3' | C2' | O2' | 64.2° | 61.1° |
O3' | C3' | C2' | H2'1 | 62.0° | 66.1° |
H3' | C3' | C2' | O2' | 168.6° | 171.1° |
H3' | C3' | C2' | H2'1 | 65.2° | 61.7° |
H3' | C3' | O3' | H3T | 57.9° | 66.6° |
C2' | O2' | C6' | H6'1 | 128.0° | 122.4° |
C2' | O2' | C6' | H6'2 | 109.8° | 115.6° |
H2'1 | C2' | O2' | C6' | 158.2° | 165.2° |
O2' | C6' | H6'1 | H6'2 | 122.5° | 122.0° |
O1P | P | O2P | OXT | 124.3° | 120.0° |
O1P | P | OXT | HXT | 65.1° | 59.9° |
O2P | P | O1P | H1P | 56.7° | 60.0° |
O2P | P | OXT | HXT | 65.9° | 180.0° |
OXT | P | O1P | H1P | 67.6° | 60.1° |