Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
P | OP1 | doub | 1.48Å | 1.48Å | |
P | OP2 | sing | 1.61Å | 1.48Å | |
P | O5' | sing | 1.61Å | 1.61Å | |
P | OP3 | sing | 1.61Å | 461.46Å | |
OP2 | HOP2 | sing | 0.97Å | 0.95Å | |
O5' | C5B | sing | 1.43Å | 1.43Å | |
C5B | C4' | sing | 1.53Å | 1.53Å | |
C5B | H5'1 | sing | 1.09Å | 1.10Å | |
C5B | H5'' | sing | 1.09Å | 1.10Å | |
C4' | C3' | sing | 1.53Å | 1.52Å | |
C4' | C5' | sing | 1.50Å | 1.53Å | |
C4' | H4' | sing | 1.09Å | 1.10Å | |
C1' | N1 | sing | 1.47Å | 1.48Å | |
C1' | C2' | sing | 1.53Å | 1.53Å | |
C1' | C6' | sing | 1.50Å | 1.53Å | |
C1' | H1' | sing | 1.09Å | 1.10Å | |
N1 | C6 | sing | 1.37Å | 1.37Å | |
N1 | C2 | sing | 1.34Å | 1.38Å | |
C6 | C5 | doub | 1.35Å | 1.35Å | |
C6 | H6 | sing | 1.08Å | 1.08Å | |
C2 | O2 | doub | 1.22Å | 1.23Å | |
C2 | N3 | sing | 1.35Å | 1.38Å | |
N3 | C4 | sing | 1.35Å | 1.38Å | |
N3 | H3 | sing | 0.97Å | 1.00Å | |
C4 | O4 | doub | 1.22Å | 1.22Å | |
C4 | C5 | sing | 1.42Å | 1.44Å | |
C5 | C5A | sing | 1.51Å | 1.53Å | |
C5A | H51 | sing | 1.09Å | 1.10Å | |
C5A | H52 | sing | 1.09Å | 1.10Å | |
C5A | H53 | sing | 1.09Å | 1.10Å | |
C2' | C3' | sing | 1.53Å | 1.52Å | |
C2' | H2' | sing | 1.09Å | 1.10Å | |
C2' | H2'' | sing | 1.09Å | 1.10Å | |
C3' | O3' | sing | 1.43Å | 1.43Å | |
C3' | H3' | sing | 1.09Å | 1.10Å | |
O3' | HO3' | sing | 0.97Å | 0.95Å | |
C5' | C6' | doub | 1.29Å | 1.32Å | |
C5' | H5' | sing | 1.08Å | 1.08Å | |
C6' | H6' | sing | 1.08Å | 1.08Å | |
OP3 | HOP3 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
OP1 | P | OP2 | 119.8° | 109.5° |
OP1 | P | O5' | 108.3° | 109.5° |
OP1 | P | OP3 | 82.6° | 109.5° |
OP2 | P | O5' | 108.0° | 109.5° |
OP2 | P | OP3 | 59.4° | 109.5° |
P | OP2 | HOP2 | 109.5° | 114.0° |
O5' | P | OP3 | 79.2° | 109.5° |
P | O5' | C5B | 120.9° | 123.0° |
P | OP3 | HOP3 | 82.7° | 114.0° |
O5' | C5B | C4' | 112.2° | 109.5° |
O5' | C5B | H5'1 | 108.6° | 109.5° |
O5' | C5B | H5'' | 108.6° | 109.5° |
C4' | C5B | H5'1 | 108.6° | 109.4° |
C4' | C5B | H5'' | 108.6° | 109.5° |
C5B | C4' | C3' | 106.3° | 109.4° |
C5B | C4' | C5' | 111.2° | 109.3° |
C5B | C4' | H4' | 111.2° | 109.3° |
H5'1 | C5B | H5'' | 110.3° | 109.5° |
C3' | C4' | C5' | 111.4° | 110.2° |
C3' | C4' | H4' | 110.9° | 109.4° |
C4' | C3' | C2' | 109.5° | 108.4° |
C4' | C3' | O3' | 110.3° | 109.6° |
C4' | C3' | H3' | 109.3° | 109.6° |
C5' | C4' | H4' | 106.0° | 109.2° |
C4' | C5' | C6' | 123.0° | 124.1° |
C4' | C5' | H5' | 118.5° | 118.0° |
N1 | C1' | C2' | 110.5° | 109.3° |
N1 | C1' | C6' | 109.2° | 109.4° |
N1 | C1' | H1' | 109.7° | 109.3° |
C1' | N1 | C6 | 121.3° | 119.7° |
C1' | N1 | C2 | 117.5° | 119.7° |
C2' | C1' | C6' | 111.5° | 110.1° |
C2' | C1' | H1' | 107.3° | 109.4° |
C1' | C2' | C3' | 111.7° | 108.5° |
C1' | C2' | H2' | 108.8° | 109.6° |
C1' | C2' | H2'' | 108.7° | 109.6° |
C6' | C1' | H1' | 108.7° | 109.2° |
C1' | C6' | C5' | 123.1° | 124.1° |
C1' | C6' | H6' | 118.5° | 117.9° |
C6 | N1 | C2 | 121.2° | 120.6° |
N1 | C6 | C5 | 121.3° | 119.7° |
N1 | C6 | H6 | 119.3° | 120.2° |
N1 | C2 | O2 | 122.5° | 119.6° |
N1 | C2 | N3 | 116.1° | 121.0° |
C5 | C6 | H6 | 119.3° | 120.1° |
C6 | C5 | C4 | 121.1° | 119.1° |
C6 | C5 | C5A | 119.8° | 120.4° |
O2 | C2 | N3 | 121.5° | 119.5° |
C2 | N3 | C4 | 126.3° | 120.2° |
C2 | N3 | H3 | 116.9° | 119.9° |
C4 | N3 | H3 | 116.8° | 119.9° |
N3 | C4 | O4 | 120.6° | 120.2° |
N3 | C4 | C5 | 114.1° | 119.4° |
O4 | C4 | C5 | 125.4° | 120.3° |
C4 | C5 | C5A | 119.1° | 120.5° |
C5 | C5A | H51 | 109.5° | 109.5° |
C5 | C5A | H52 | 109.5° | 109.5° |
C5 | C5A | H53 | 109.5° | 109.5° |
H51 | C5A | H52 | 109.5° | 109.4° |
H51 | C5A | H53 | 109.5° | 109.5° |
H52 | C5A | H53 | 109.5° | 109.5° |
C3' | C2' | H2' | 108.7° | 109.7° |
C3' | C2' | H2'' | 108.8° | 109.6° |
C2' | C3' | O3' | 110.6° | 109.7° |
C2' | C3' | H3' | 109.0° | 109.6° |
H2' | C2' | H2'' | 110.2° | 109.8° |
O3' | C3' | H3' | 108.2° | 109.8° |
C3' | O3' | HO3' | 109.5° | 114.0° |
C6' | C5' | H5' | 118.5° | 118.0° |
C5' | C6' | H6' | 118.4° | 118.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
OP1 | P | OP2 | O5' | 124.5° | 120.0° |
OP1 | P | OP2 | OP3 | 59.4° | 120.0° |
OP1 | P | O5' | OP3 | 78.4° | 120.0° |
OP1 | P | OP2 | HOP2 | 0.0° | 60.0° |
OP1 | P | O5' | C5B | 33.8° | 55.0° |
OP1 | P | OP3 | HOP3 | 180.0° | 180.0° |
OP2 | P | O5' | OP3 | 52.6° | 120.0° |
OP2 | P | O5' | C5B | 164.9° | 175.0° |
OP2 | P | OP3 | HOP3 | 48.9° | 60.0° |
O5' | P | OP2 | HOP2 | 124.4° | 180.0° |
P | O5' | C5B | C4' | 166.4° | 180.0° |
P | O5' | C5B | H5'1 | 73.6° | 60.0° |
P | O5' | C5B | H5'' | 46.4° | 60.0° |
O5' | P | OP3 | HOP3 | 69.7° | 60.0° |
OP3 | P | OP2 | HOP2 | 59.4° | 60.0° |
OP3 | P | O5' | C5B | 112.3° | 65.0° |
O5' | C5B | C4' | H5'1 | 120.0° | 120.0° |
O5' | C5B | C4' | H5'' | 120.0° | 120.1° |
O5' | C5B | H5'1 | H5'' | 118.9° | 120.0° |
O5' | C5B | C4' | C3' | 68.6° | 175.0° |
O5' | C5B | C4' | C5' | 52.8° | 64.3° |
O5' | C5B | C4' | H4' | 170.6° | 55.2° |
C4' | C5B | H5'1 | H5'' | 118.9° | 120.0° |
C5B | C4' | C3' | C5' | 121.2° | 120.2° |
C5B | C4' | C3' | H4' | 121.0° | 119.7° |
C5B | C4' | C5' | H4' | 120.9° | 119.5° |
C5B | C4' | C3' | C2' | 72.4° | 169.7° |
C5B | C4' | C3' | O3' | 165.7° | 70.6° |
C5B | C4' | C3' | H3' | 46.9° | 50.0° |
C5B | C4' | C5' | C6' | 99.8° | 137.4° |
C5B | C4' | C5' | H5' | 80.2° | 42.7° |
H5'1 | C5B | C4' | C3' | 51.4° | 65.0° |
H5'1 | C5B | C4' | C5' | 172.8° | 55.7° |
H5'1 | C5B | C4' | H4' | 69.4° | 175.2° |
H5'' | C5B | C4' | C3' | 171.4° | 55.0° |
H5'' | C5B | C4' | C5' | 67.2° | 175.7° |
H5'' | C5B | C4' | H4' | 50.6° | 64.8° |
C3' | C4' | C5' | H4' | 120.7° | 120.2° |
C4' | C3' | C2' | C1' | 63.5° | 67.4° |
C4' | C3' | C2' | O3' | 121.7° | 119.7° |
C4' | C3' | C2' | H3' | 119.5° | 119.7° |
C4' | C3' | C2' | H2' | 176.5° | 52.3° |
C4' | C3' | C2' | H2'' | 56.5° | 172.9° |
C4' | C3' | O3' | H3' | 119.5° | 120.5° |
C4' | C3' | O3' | HO3' | 180.0° | 180.0° |
C3' | C4' | C5' | C6' | 18.5° | 17.2° |
C3' | C4' | C5' | H5' | 161.4° | 162.9° |
C4' | C5' | C6' | C1' | 0.0° | 0.5° |
C5' | C4' | C3' | C2' | 48.8° | 49.4° |
C5' | C4' | C3' | O3' | 73.1° | 169.1° |
C5' | C4' | C3' | H3' | 168.1° | 70.2° |
C4' | C5' | C6' | H5' | 180.0° | 179.9° |
C4' | C5' | C6' | H6' | 180.0° | 179.6° |
H4' | C4' | C3' | C2' | 166.6° | 70.6° |
H4' | C4' | C3' | O3' | 44.7° | 49.1° |
H4' | C4' | C3' | H3' | 74.1° | 169.7° |
H4' | C4' | C5' | C6' | 139.3° | 103.0° |
H4' | C4' | C5' | H5' | 40.7° | 76.9° |
N1 | C1' | C2' | C6' | 121.6° | 120.2° |
N1 | C1' | C2' | H1' | 119.5° | 119.7° |
N1 | C1' | C6' | H1' | 119.6° | 119.6° |
C1' | N1 | C6 | C2 | 179.9° | 179.7° |
C1' | N1 | C6 | C5 | 179.7° | 180.0° |
C1' | N1 | C6 | H6 | 0.2° | 0.0° |
C1' | N1 | C2 | O2 | 0.3° | 0.0° |
C1' | N1 | C2 | N3 | 180.0° | 180.0° |
N1 | C1' | C2' | C3' | 165.5° | 70.8° |
N1 | C1' | C2' | H2' | 74.5° | 169.5° |
N1 | C1' | C2' | H2'' | 45.5° | 48.9° |
N1 | C1' | C6' | C5' | 134.9° | 103.0° |
N1 | C1' | C6' | H6' | 45.1° | 76.9° |
C2' | C1' | C6' | H1' | 118.1° | 120.2° |
C2' | C1' | N1 | C6 | 44.6° | 70.5° |
C2' | C1' | N1 | C2 | 135.5° | 109.2° |
C1' | C2' | C3' | H2' | 120.0° | 119.7° |
C1' | C2' | C3' | H2'' | 120.0° | 119.7° |
C1' | C2' | H2' | H2'' | 119.1° | 120.5° |
C1' | C2' | C3' | O3' | 58.2° | 172.9° |
C1' | C2' | C3' | H3' | 177.0° | 52.2° |
C2' | C1' | C6' | C5' | 12.6° | 17.2° |
C2' | C1' | C6' | H6' | 167.4° | 162.9° |
C6' | C1' | N1 | C6 | 78.3° | 50.2° |
C6' | C1' | N1 | C2 | 101.6° | 130.1° |
C6' | C1' | C2' | C3' | 44.0° | 49.5° |
C6' | C1' | C2' | H2' | 164.0° | 70.3° |
C6' | C1' | C2' | H2'' | 76.1° | 169.1° |
C1' | C6' | C5' | H6' | 180.0° | 179.9° |
C1' | C6' | C5' | H5' | 180.0° | 179.6° |
H1' | C1' | N1 | C6 | 162.7° | 169.7° |
H1' | C1' | N1 | C2 | 17.4° | 10.5° |
H1' | C1' | C2' | C3' | 74.9° | 169.5° |
H1' | C1' | C2' | H2' | 45.1° | 49.8° |
H1' | C1' | C2' | H2'' | 165.0° | 70.8° |
H1' | C1' | C6' | C5' | 105.5° | 137.3° |
H1' | C1' | C6' | H6' | 74.5° | 42.8° |
N1 | C6 | C5 | H6 | 180.0° | 179.9° |
C6 | N1 | C2 | O2 | 179.8° | 179.7° |
C6 | N1 | C2 | N3 | 0.1° | 0.3° |
N1 | C6 | C5 | C4 | 0.3° | 0.1° |
N1 | C6 | C5 | C5A | 179.4° | 180.0° |
C2 | N1 | C6 | C5 | 0.3° | 0.2° |
C2 | N1 | C6 | H6 | 179.7° | 179.7° |
N1 | C2 | O2 | N3 | 179.7° | 180.0° |
N1 | C2 | N3 | C4 | 0.2° | 0.0° |
N1 | C2 | N3 | H3 | 179.8° | 180.0° |
C6 | C5 | C4 | N3 | 0.1° | 0.3° |
C6 | C5 | C4 | O4 | 179.7° | 180.0° |
C6 | C5 | C4 | C5A | 179.7° | 179.9° |
C6 | C5 | C5A | H51 | 180.0° | 90.1° |
C6 | C5 | C5A | H52 | 60.0° | 150.0° |
C6 | C5 | C5A | H53 | 60.0° | 30.0° |
H6 | C6 | C5 | C4 | 179.7° | 180.0° |
H6 | C6 | C5 | C5A | 0.6° | 0.1° |
O2 | C2 | N3 | C4 | 179.5° | 180.0° |
O2 | C2 | N3 | H3 | 0.5° | 0.0° |
C2 | N3 | C4 | H3 | 180.0° | 180.0° |
C2 | N3 | C4 | O4 | 179.4° | 180.0° |
C2 | N3 | C4 | C5 | 0.2° | 0.3° |
N3 | C4 | O4 | C5 | 179.6° | 179.7° |
N3 | C4 | C5 | C5A | 179.6° | 179.8° |
H3 | N3 | C4 | O4 | 0.6° | 0.0° |
H3 | N3 | C4 | C5 | 179.8° | 179.7° |
O4 | C4 | C5 | C5A | 0.0° | 0.1° |
C4 | C5 | C5A | H51 | 0.3° | 90.0° |
C4 | C5 | C5A | H52 | 120.3° | 29.9° |
C4 | C5 | C5A | H53 | 119.7° | 149.9° |
C5 | C5A | H51 | H52 | 120.0° | 120.0° |
C5 | C5A | H51 | H53 | 120.0° | 120.0° |
C5 | C5A | H52 | H53 | 120.0° | 120.0° |
H51 | C5A | H52 | H53 | 120.0° | 120.0° |
C3' | C2' | H2' | H2'' | 119.1° | 120.5° |
C2' | C3' | O3' | H3' | 119.3° | 120.5° |
C2' | C3' | O3' | HO3' | 58.7° | 61.0° |
H2' | C2' | C3' | O3' | 61.8° | 67.4° |
H2' | C2' | C3' | H3' | 57.0° | 172.0° |
H2'' | C2' | C3' | O3' | 178.3° | 53.2° |
H2'' | C2' | C3' | H3' | 63.0° | 67.5° |
H3' | C3' | O3' | HO3' | 60.6° | 59.5° |
H5' | C5' | C6' | H6' | 0.0° | 0.3° |