UWJ
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
OP2 | P | doub | 1.48Å | 1.47Å | |
P | OP1 | sing | 1.61Å | 1.44Å | |
P | O5' | sing | 1.61Å | 1.65Å | |
C5' | O5' | sing | 1.43Å | 1.45Å | |
C5' | C4' | sing | 1.53Å | 1.54Å | |
C4' | O4' | sing | 1.44Å | 1.46Å | |
C4' | C3' | sing | 1.55Å | 1.54Å | |
O4' | C1' | sing | 1.44Å | 1.48Å | |
C7 | C5 | sing | 1.51Å | 1.46Å | |
C6 | C5 | doub | 1.35Å | 1.34Å | |
C6 | N1 | sing | 1.37Å | 1.37Å | |
C5 | C4 | sing | 1.42Å | 1.41Å | |
C3' | O3' | sing | 1.43Å | 1.41Å | |
C3' | C2' | sing | 1.55Å | 1.63Å | |
C1' | N1 | sing | 1.47Å | 1.48Å | |
C1' | C2' | sing | 1.54Å | 1.50Å | |
O4 | C4 | doub | 1.22Å | 1.23Å | |
N1 | C2 | sing | 1.34Å | 1.39Å | |
C4 | N3 | sing | 1.35Å | 1.38Å | |
C2 | N3 | sing | 1.35Å | 1.35Å | |
C2 | O2 | doub | 1.22Å | 1.24Å | |
C2' | SE2 | sing | 1.96Å | 1.86Å | |
SE2 | CA' | sing | 1.96Å | 1.97Å | |
P | O1 | sing | 1.61Å | 1.62Å | |
C6 | H6 | sing | 1.08Å | 1.08Å | |
OP1 | H1 | sing | 0.97Å | 0.95Å | |
C5' | H5'1 | sing | 1.09Å | 1.10Å | |
C5' | H5'2 | sing | 1.09Å | 1.10Å | |
C4' | H4' | sing | 1.09Å | 1.10Å | |
C3' | H3' | sing | 1.09Å | 1.10Å | |
O3' | HO3' | sing | 0.97Å | 0.95Å | |
C2' | H2' | sing | 1.09Å | 1.10Å | |
CA' | HA'1 | sing | 1.09Å | 1.10Å | |
CA' | HA'3 | sing | 1.09Å | 1.10Å | |
CA' | HA'2 | sing | 1.09Å | 1.10Å | |
C1' | H1' | sing | 1.09Å | 1.10Å | |
C7 | H72 | sing | 1.09Å | 1.10Å | |
C7 | H2 | sing | 1.09Å | 1.10Å | |
C7 | H71 | sing | 1.09Å | 1.10Å | |
N3 | H3 | sing | 0.97Å | 1.00Å | |
O1 | H4 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
OP2 | P | OP1 | 123.7° | 109.5° |
OP2 | P | O5' | 102.2° | 109.5° |
OP2 | P | O1 | 105.6° | 109.5° |
OP1 | P | O5' | 112.9° | 109.5° |
OP1 | P | O1 | 107.8° | 109.5° |
P | OP1 | H1 | 109.5° | 114.0° |
P | O5' | C5' | 123.7° | 123.0° |
O5' | P | O1 | 102.4° | 109.5° |
O5' | C5' | C4' | 110.6° | 109.5° |
O5' | C5' | H5'1 | 109.2° | 109.6° |
O5' | C5' | H5'2 | 109.2° | 109.5° |
C5' | C4' | O4' | 104.4° | 110.6° |
C5' | C4' | C3' | 115.1° | 110.7° |
C4' | C5' | H5'1 | 109.2° | 109.4° |
C4' | C5' | H5'2 | 109.2° | 109.4° |
C5' | C4' | H4' | 109.9° | 110.5° |
O4' | C4' | C3' | 106.4° | 103.5° |
C4' | O4' | C1' | 106.7° | 107.0° |
O4' | C4' | H4' | 111.0° | 110.6° |
C4' | C3' | O3' | 105.1° | 110.9° |
C4' | C3' | C2' | 103.5° | 102.1° |
C3' | C4' | H4' | 109.8° | 110.8° |
C4' | C3' | H3' | 111.0° | 110.9° |
O4' | C1' | N1 | 105.4° | 109.9° |
O4' | C1' | C2' | 103.9° | 107.3° |
O4' | C1' | H1' | 108.5° | 109.8° |
C7 | C5 | C6 | 122.6° | 120.5° |
C7 | C5 | C4 | 118.5° | 120.5° |
C5 | C7 | H72 | 109.5° | 109.4° |
C5 | C7 | H2 | 109.4° | 109.5° |
C5 | C7 | H71 | 109.5° | 109.5° |
C5 | C6 | N1 | 122.0° | 119.7° |
C6 | C5 | C4 | 118.8° | 119.1° |
C5 | C6 | H6 | 119.0° | 120.1° |
C6 | N1 | C1' | 122.4° | 119.7° |
C6 | N1 | C2 | 120.2° | 120.6° |
N1 | C6 | H6 | 119.0° | 120.2° |
C5 | C4 | O4 | 126.0° | 120.3° |
C5 | C4 | N3 | 118.1° | 119.4° |
O3' | C3' | C2' | 113.7° | 110.9° |
O3' | C3' | H3' | 113.2° | 110.8° |
C3' | O3' | HO3' | 109.5° | 114.0° |
C3' | C2' | C1' | 101.0° | 104.2° |
C3' | C2' | SE2 | 116.8° | 110.5° |
C2' | C3' | H3' | 109.8° | 111.0° |
C3' | C2' | H2' | 108.2° | 110.5° |
N1 | C1' | C2' | 121.9° | 109.9° |
C1' | N1 | C2 | 116.9° | 119.7° |
N1 | C1' | H1' | 108.4° | 109.9° |
C1' | C2' | SE2 | 114.9° | 110.5° |
C1' | C2' | H2' | 109.8° | 110.6° |
C2' | C1' | H1' | 108.1° | 110.0° |
O4 | C4 | N3 | 115.9° | 120.3° |
N1 | C2 | N3 | 117.8° | 121.0° |
N1 | C2 | O2 | 121.8° | 119.5° |
C4 | N3 | C2 | 122.9° | 120.2° |
C4 | N3 | H3 | 118.6° | 119.9° |
N3 | C2 | O2 | 120.3° | 119.5° |
C2 | N3 | H3 | 118.6° | 119.9° |
C2' | SE2 | CA' | 92.7° | 101.0° |
SE2 | C2' | H2' | 105.9° | 110.4° |
SE2 | CA' | HA'1 | 109.5° | 109.4° |
SE2 | CA' | HA'3 | 109.5° | 109.5° |
SE2 | CA' | HA'2 | 109.5° | 109.5° |
P | O1 | H4 | 109.5° | 114.0° |
H5'1 | C5' | H5'2 | 109.5° | 109.5° |
HA'1 | CA' | HA'3 | 109.5° | 109.5° |
HA'1 | CA' | HA'2 | 109.4° | 109.5° |
HA'3 | CA' | HA'2 | 109.5° | 109.5° |
H72 | C7 | H2 | 109.5° | 109.4° |
H72 | C7 | H71 | 109.4° | 109.5° |
H2 | C7 | H71 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
OP2 | P | OP1 | O5' | 123.9° | 120.0° |
OP2 | P | OP1 | O1 | 123.7° | 120.0° |
OP2 | P | O5' | O1 | 109.3° | 120.0° |
OP2 | P | O5' | C5' | 52.7° | 54.9° |
OP2 | P | OP1 | H1 | 0.0° | 60.0° |
OP2 | P | O1 | H4 | 0.0° | 180.0° |
OP1 | P | O5' | O1 | 115.7° | 120.0° |
OP1 | P | O5' | C5' | 172.3° | 174.9° |
OP1 | P | O1 | H4 | 134.0° | 60.0° |
P | O5' | C5' | C4' | 167.4° | 180.0° |
O5' | P | OP1 | H1 | 123.9° | 180.0° |
P | O5' | C5' | H5'1 | 72.4° | 60.0° |
P | O5' | C5' | H5'2 | 47.2° | 60.1° |
O5' | P | O1 | H4 | 106.7° | 60.0° |
O5' | C5' | C4' | H5'1 | 120.2° | 120.1° |
O5' | C5' | C4' | H5'2 | 120.2° | 119.9° |
O5' | C5' | C4' | O4' | 52.3° | 66.4° |
O5' | C5' | C4' | C3' | 63.9° | 179.4° |
C5' | O5' | P | O1 | 56.6° | 65.0° |
O5' | C5' | H5'1 | H5'2 | 119.5° | 120.0° |
O5' | C5' | C4' | H4' | 171.5° | 56.4° |
C5' | C4' | O4' | C3' | 122.1° | 118.6° |
C5' | C4' | O4' | H4' | 118.4° | 122.8° |
C5' | C4' | C3' | H4' | 124.6° | 123.0° |
C5' | C4' | O4' | C1' | 149.4° | 158.6° |
C5' | C4' | C3' | O3' | 123.6° | 86.3° |
C5' | C4' | C3' | C2' | 116.9° | 155.5° |
C4' | C5' | H5'1 | H5'2 | 119.5° | 119.9° |
C5' | C4' | C3' | H3' | 0.9° | 37.2° |
O4' | C4' | C3' | H4' | 120.3° | 118.5° |
O4' | C4' | C3' | O3' | 121.3° | 155.2° |
O4' | C4' | C3' | C2' | 1.8° | 37.0° |
C4' | O4' | C1' | N1 | 172.9° | 145.9° |
C4' | O4' | C1' | C2' | 43.7° | 26.5° |
O4' | C4' | C5' | H5'1 | 172.5° | 53.7° |
O4' | C4' | C5' | H5'2 | 67.9° | 173.6° |
O4' | C4' | C3' | H3' | 116.0° | 81.3° |
C4' | O4' | C1' | H1' | 71.1° | 93.1° |
C3' | C4' | O4' | C1' | 27.3° | 40.0° |
C4' | C3' | O3' | C2' | 112.5° | 112.7° |
C4' | C3' | O3' | H3' | 121.3° | 123.5° |
C4' | C3' | C2' | H3' | 118.6° | 118.2° |
C4' | C3' | C2' | C1' | 23.2° | 20.9° |
C4' | C3' | C2' | SE2 | 102.2° | 139.6° |
C3' | C4' | C5' | H5'1 | 56.3° | 60.4° |
C3' | C4' | C5' | H5'2 | 175.9° | 59.5° |
C4' | C3' | O3' | HO3' | 180.0° | 61.4° |
C4' | C3' | C2' | H2' | 138.5° | 97.9° |
O4' | C1' | N1 | C6 | 46.4° | 126.4° |
O4' | C1' | C2' | C3' | 39.8° | 2.0° |
O4' | C1' | N1 | C2' | 117.6° | 117.8° |
O4' | C1' | N1 | H1' | 116.0° | 121.0° |
O4' | C1' | C2' | H1' | 115.1° | 119.5° |
O4' | C1' | N1 | C2 | 125.4° | 53.6° |
O4' | C1' | C2' | SE2 | 86.8° | 116.7° |
C1' | O4' | C4' | H4' | 92.2° | 78.6° |
O4' | C1' | C2' | H2' | 153.9° | 120.7° |
C7 | C5 | C6 | C4 | 175.3° | 179.7° |
C7 | C5 | C6 | N1 | 179.1° | 180.0° |
C7 | C5 | C4 | O4 | 2.7° | 0.2° |
C7 | C5 | C4 | N3 | 178.5° | 179.7° |
C7 | C5 | C6 | H6 | 0.9° | 0.3° |
C5 | C7 | H72 | H2 | 120.0° | 119.9° |
C5 | C7 | H72 | H71 | 120.0° | 120.0° |
C5 | C7 | H2 | H71 | 120.0° | 120.1° |
C5 | C6 | N1 | H6 | 180.0° | 179.6° |
C5 | C6 | N1 | C1' | 174.5° | 179.9° |
C6 | C5 | C4 | O4 | 172.8° | 179.9° |
C5 | C6 | N1 | C2 | 2.9° | 0.1° |
C6 | C5 | C4 | N3 | 6.0° | 0.5° |
C6 | C5 | C7 | H72 | 180.0° | 90.0° |
C6 | C5 | C7 | H2 | 60.0° | 150.1° |
C6 | C5 | C7 | H71 | 60.0° | 30.0° |
N1 | C6 | C5 | C4 | 5.6° | 0.3° |
C6 | N1 | C1' | C2 | 171.8° | 180.0° |
C6 | N1 | C1' | C2' | 71.2° | 115.7° |
C6 | N1 | C2 | N3 | 0.5° | 0.0° |
C6 | N1 | C2 | O2 | 177.3° | 179.7° |
C6 | N1 | C1' | H1' | 162.4° | 5.5° |
C5 | C4 | O4 | N3 | 178.8° | 179.5° |
C5 | C4 | N3 | C2 | 3.8° | 0.5° |
C4 | C5 | C6 | H6 | 174.4° | 180.0° |
C4 | C5 | C7 | H72 | 4.7° | 89.7° |
C4 | C5 | C7 | H2 | 115.3° | 30.2° |
C4 | C5 | C7 | H71 | 124.7° | 150.3° |
C5 | C4 | N3 | H3 | 176.1° | 179.5° |
O3' | C3' | C2' | H3' | 127.9° | 123.6° |
O3' | C3' | C2' | C1' | 90.3° | 139.1° |
O3' | C3' | C2' | SE2 | 144.3° | 102.2° |
O3' | C3' | C4' | H4' | 1.0° | 36.7° |
O3' | C3' | C2' | H2' | 25.0° | 20.3° |
C3' | C2' | C1' | N1 | 158.2° | 121.4° |
C3' | C2' | C1' | SE2 | 126.7° | 118.7° |
C3' | C2' | C1' | H2' | 114.1° | 118.7° |
C3' | C2' | SE2 | H2' | 120.5° | 122.5° |
C3' | C2' | SE2 | CA' | 66.3° | 61.4° |
C2' | C3' | C4' | H4' | 118.5° | 81.5° |
C2' | C3' | O3' | HO3' | 67.5° | 174.2° |
C3' | C2' | C1' | H1' | 75.3° | 117.4° |
N1 | C1' | C2' | H1' | 126.5° | 121.1° |
C1' | N1 | C2 | N3 | 172.5° | 180.0° |
C1' | N1 | C2 | O2 | 10.7° | 0.3° |
N1 | C1' | C2' | SE2 | 31.6° | 2.8° |
C1' | N1 | C6 | H6 | 5.5° | 0.3° |
N1 | C1' | C2' | H2' | 87.7° | 119.8° |
C2' | C1' | N1 | C2 | 116.9° | 64.3° |
C1' | C2' | SE2 | H2' | 121.4° | 122.7° |
C1' | C2' | SE2 | CA' | 175.6° | 176.2° |
C1' | C2' | C3' | H3' | 141.8° | 97.3° |
O4 | C4 | N3 | C2 | 175.1° | 180.0° |
O4 | C4 | N3 | H3 | 4.9° | 0.0° |
N1 | C2 | N3 | C4 | 1.1° | 0.3° |
N1 | C2 | N3 | O2 | 176.8° | 179.7° |
C2 | N1 | C6 | H6 | 177.1° | 179.7° |
C2 | N1 | C1' | H1' | 9.4° | 174.5° |
N1 | C2 | N3 | H3 | 178.8° | 179.7° |
C4 | N3 | C2 | H3 | 180.0° | 180.0° |
C4 | N3 | C2 | O2 | 177.9° | 180.0° |
O2 | C2 | N3 | H3 | 2.0° | 0.0° |
SE2 | C2' | C3' | H3' | 16.4° | 21.4° |
C2' | SE2 | CA' | HA'1 | 180.0° | 180.0° |
C2' | SE2 | CA' | HA'3 | 60.0° | 60.0° |
C2' | SE2 | CA' | HA'2 | 60.0° | 60.0° |
SE2 | C2' | C1' | H1' | 158.0° | 123.9° |
CA' | SE2 | C2' | H2' | 54.2° | 61.1° |
SE2 | CA' | HA'1 | HA'3 | 120.0° | 120.0° |
SE2 | CA' | HA'1 | HA'2 | 120.0° | 120.0° |
SE2 | CA' | HA'3 | HA'2 | 120.0° | 120.0° |
O1 | P | OP1 | H1 | 123.7° | 60.0° |
H5'1 | C5' | C4' | H4' | 68.3° | 176.5° |
H5'2 | C5' | C4' | H4' | 51.3° | 63.6° |
H4' | C4' | C3' | H3' | 123.7° | 160.2° |
H3' | C3' | O3' | HO3' | 58.7° | 62.1° |
H3' | C3' | C2' | H2' | 102.9° | 143.9° |
H2' | C2' | C1' | H1' | 38.8° | 1.3° |
HA'1 | CA' | HA'3 | HA'2 | 119.9° | 120.0° |
H72 | C7 | H2 | H71 | 120.0° | 120.0° |