6OP
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O4 | C4 | doub | 1.22Å | 1.25Å | |
N3 | C4 | sing | 1.35Å | 1.35Å | |
N3 | C2 | sing | 1.35Å | 1.34Å | |
O2 | C2 | doub | 1.22Å | 1.20Å | |
C4 | C5 | sing | 1.42Å | 1.39Å | |
C2 | N1 | sing | 1.35Å | 1.34Å | |
C5 | C7 | sing | 1.51Å | 1.55Å | |
C5 | C6 | doub | 1.35Å | 1.40Å | |
N1 | C6 | sing | 1.37Å | 1.37Å | |
N1 | C1' | sing | 1.47Å | 1.51Å | |
C1' | O4' | sing | 1.44Å | 1.52Å | |
C1' | C2' | sing | 1.54Å | 1.23Å | |
CB' | CG' | sing | 1.53Å | 1.55Å | |
CB' | O2' | sing | 1.43Å | 1.44Å | |
O4' | C4' | sing | 1.44Å | 1.53Å | |
CG' | OD' | sing | 1.43Å | 1.45Å | |
C2' | O2' | sing | 1.43Å | 1.44Å | |
C2' | C3' | sing | 1.55Å | 1.64Å | |
C4' | C3' | sing | 1.55Å | 1.23Å | |
C4' | C5' | sing | 1.51Å | 1.60Å | |
O3' | C3' | sing | 1.43Å | 1.44Å | |
OD' | CE' | sing | 1.43Å | 1.42Å | |
C6' | C5' | doub | 1.31Å | 1.53Å | |
C6' | P | sing | 1.81Å | 1.78Å | |
OP2 | P | doub | 1.48Å | 1.48Å | |
P | OP1 | sing | 1.61Å | 1.60Å | |
P | OP3 | sing | 1.61Å | 1.54Å | |
OP1 | H1 | sing | 0.97Å | 0.95Å | |
OP3 | HOP3 | sing | 0.97Å | 0.95Å | |
C6' | H6' | sing | 1.08Å | 1.08Å | |
C5' | H5' | sing | 1.08Å | 1.08Å | |
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 | |
C1' | H1' | sing | 1.09Å | 1.10Å | |
CB' | H12 | sing | 1.09Å | 1.10Å | |
CB' | H13 | sing | 1.09Å | 1.10Å | |
CG' | H14 | sing | 1.09Å | 1.10Å | |
CG' | H15 | sing | 1.09Å | 1.10Å | |
CE' | H16 | sing | 1.09Å | 1.10Å | |
CE' | H17 | sing | 1.09Å | 1.10Å | |
CE' | H18 | sing | 1.09Å | 1.10Å | |
N3 | H3 | sing | 0.97Å | 1.00Å | |
C7 | H20 | sing | 1.09Å | 1.10Å | |
C7 | H21 | sing | 1.09Å | 1.10Å | |
C7 | H22 | sing | 1.09Å | 1.10Å | |
C6 | H6 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O4 | C4 | N3 | 120.9° | 120.3° |
O4 | C4 | C5 | 118.0° | 120.3° |
C4 | N3 | C2 | 119.7° | 120.3° |
N3 | C4 | C5 | 121.1° | 119.4° |
C4 | N3 | H3 | 120.2° | 119.9° |
N3 | C2 | O2 | 118.2° | 119.6° |
N3 | C2 | N1 | 122.0° | 120.9° |
C2 | N3 | H3 | 120.2° | 119.8° |
O2 | C2 | N1 | 119.8° | 119.5° |
C4 | C5 | C7 | 120.9° | 120.4° |
C4 | C5 | C6 | 117.7° | 119.1° |
C2 | N1 | C6 | 120.0° | 120.6° |
C2 | N1 | C1' | 119.9° | 119.7° |
C7 | C5 | C6 | 121.4° | 120.5° |
C5 | C7 | H20 | 109.5° | 109.4° |
C5 | C7 | H21 | 109.4° | 109.5° |
C5 | C7 | H22 | 109.5° | 109.4° |
C5 | C6 | N1 | 119.5° | 119.7° |
C5 | C6 | H6 | 120.2° | 120.2° |
C6 | N1 | C1' | 120.1° | 119.7° |
N1 | C6 | H6 | 120.2° | 120.1° |
N1 | C1' | O4' | 106.5° | 110.3° |
N1 | C1' | C2' | 113.5° | 110.4° |
N1 | C1' | H1' | 110.3° | 110.4° |
O4' | C1' | C2' | 100.3° | 104.8° |
C1' | O4' | C4' | 105.1° | 105.3° |
O4' | C1' | H1' | 110.2° | 110.4° |
C1' | C2' | O2' | 113.5° | 110.5° |
C1' | C2' | C3' | 104.0° | 104.1° |
C1' | C2' | H2' | 112.9° | 110.6° |
C2' | C1' | H1' | 115.1° | 110.4° |
CG' | CB' | O2' | 109.8° | 109.5° |
CB' | CG' | OD' | 106.2° | 109.5° |
CG' | CB' | H12 | 109.4° | 109.5° |
CG' | CB' | H13 | 109.4° | 109.5° |
CB' | CG' | H14 | 110.3° | 109.4° |
CB' | CG' | H15 | 110.3° | 109.4° |
CB' | O2' | C2' | 116.4° | 114.0° |
O2' | CB' | H12 | 109.4° | 109.4° |
O2' | CB' | H13 | 109.4° | 109.5° |
O4' | C4' | C3' | 105.6° | 104.8° |
O4' | C4' | C5' | 110.7° | 110.4° |
O4' | C4' | H4' | 108.2° | 110.5° |
CG' | OD' | CE' | 115.6° | 114.0° |
OD' | CG' | H14 | 110.3° | 109.5° |
OD' | CG' | H15 | 110.3° | 109.5° |
O2' | C2' | C3' | 109.7° | 110.5° |
O2' | C2' | H2' | 109.5° | 110.5° |
C2' | C3' | C4' | 105.4° | 104.0° |
C2' | C3' | O3' | 111.1° | 110.6° |
C2' | C3' | H3' | 107.4° | 110.5° |
C3' | C2' | H2' | 107.0° | 110.5° |
C3' | C4' | C5' | 111.9° | 110.4° |
C4' | C3' | O3' | 109.3° | 110.5° |
C3' | C4' | H4' | 113.0° | 110.3° |
C4' | C3' | H3' | 113.6° | 110.5° |
C4' | C5' | C6' | 109.0° | 120.0° |
C4' | C5' | H5' | 125.5° | 120.0° |
C5' | C4' | H4' | 107.5° | 110.3° |
O3' | C3' | H3' | 109.9° | 110.5° |
C3' | O3' | HO3' | 109.5° | 113.9° |
OD' | CE' | H16 | 109.5° | 109.5° |
OD' | CE' | H17 | 109.5° | 109.5° |
OD' | CE' | H18 | 109.5° | 109.5° |
C5' | C6' | P | 114.5° | 120.0° |
C5' | C6' | H6' | 122.8° | 120.0° |
C6' | C5' | H5' | 125.5° | 120.0° |
C6' | P | OP2 | 108.8° | 109.5° |
C6' | P | OP1 | 109.3° | 109.5° |
C6' | P | OP3 | 111.6° | 109.5° |
P | C6' | H6' | 122.8° | 120.0° |
OP2 | P | OP1 | 111.1° | 109.5° |
OP2 | P | OP3 | 106.7° | 109.5° |
OP1 | P | OP3 | 109.2° | 109.5° |
P | OP1 | H1 | 109.5° | 114.0° |
P | OP3 | HOP3 | 109.5° | 114.0° |
H12 | CB' | H13 | 109.5° | 109.4° |
H14 | CG' | H15 | 109.5° | 109.5° |
H16 | CE' | H17 | 109.5° | 109.4° |
H16 | CE' | H18 | 109.4° | 109.5° |
H17 | CE' | H18 | 109.5° | 109.5° |
H20 | C7 | H21 | 109.4° | 109.5° |
H20 | C7 | H22 | 109.5° | 109.5° |
H21 | C7 | H22 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O4 | C4 | N3 | C5 | 179.9° | 180.0° |
O4 | C4 | N3 | C2 | 179.9° | 179.9° |
O4 | C4 | C5 | C7 | 0.3° | 0.0° |
O4 | C4 | C5 | C6 | 179.8° | 179.9° |
O4 | C4 | N3 | H3 | 0.1° | 0.0° |
C4 | N3 | C2 | H3 | 180.0° | 179.9° |
C4 | N3 | C2 | O2 | 179.8° | 179.9° |
C4 | N3 | C2 | N1 | 0.5° | 0.1° |
N3 | C4 | C5 | C7 | 179.9° | 179.9° |
N3 | C4 | C5 | C6 | 0.1° | 0.1° |
N3 | C2 | O2 | N1 | 179.4° | 180.0° |
C2 | N3 | C4 | C5 | 0.0° | 0.1° |
N3 | C2 | N1 | C6 | 1.0° | 0.1° |
N3 | C2 | N1 | C1' | 179.4° | 179.7° |
O2 | C2 | N1 | C6 | 179.6° | 179.9° |
O2 | C2 | N1 | C1' | 1.2° | 0.3° |
O2 | C2 | N3 | H3 | 0.2° | 0.0° |
C4 | C5 | C7 | C6 | 180.0° | 180.0° |
C4 | C5 | C6 | N1 | 0.7° | 0.1° |
C5 | C4 | N3 | H3 | 180.0° | 180.0° |
C4 | C5 | C7 | H20 | 180.0° | 0.0° |
C4 | C5 | C7 | H21 | 60.0° | 120.0° |
C4 | C5 | C7 | H22 | 60.0° | 120.0° |
C4 | C5 | C6 | H6 | 179.3° | 179.7° |
C2 | N1 | C6 | C5 | 1.1° | 0.1° |
C2 | N1 | C6 | C1' | 178.4° | 179.6° |
C2 | N1 | C1' | O4' | 114.9° | 53.9° |
C2 | N1 | C1' | C2' | 135.6° | 61.5° |
C2 | N1 | C1' | H1' | 4.7° | 176.2° |
N1 | C2 | N3 | H3 | 179.5° | 180.0° |
C2 | N1 | C6 | H6 | 178.9° | 179.7° |
C7 | C5 | C6 | N1 | 179.3° | 179.9° |
C5 | C7 | H20 | H21 | 120.0° | 120.0° |
C5 | C7 | H20 | H22 | 120.0° | 120.0° |
C5 | C7 | H21 | H22 | 120.0° | 120.0° |
C7 | C5 | C6 | H6 | 0.7° | 0.2° |
C5 | C6 | N1 | H6 | 180.0° | 179.8° |
C5 | C6 | N1 | C1' | 179.5° | 179.7° |
C6 | C5 | C7 | H20 | 0.0° | 180.0° |
C6 | C5 | C7 | H21 | 120.0° | 60.0° |
C6 | C5 | C7 | H22 | 120.0° | 60.0° |
C6 | N1 | C1' | O4' | 63.4° | 126.5° |
C6 | N1 | C1' | C2' | 46.0° | 118.1° |
C6 | N1 | C1' | H1' | 177.0° | 4.2° |
N1 | C1' | O4' | C2' | 118.5° | 118.9° |
N1 | C1' | O4' | H1' | 119.6° | 122.2° |
N1 | C1' | C2' | H1' | 128.5° | 122.3° |
N1 | C1' | O4' | C4' | 152.8° | 159.4° |
N1 | C1' | C2' | O2' | 85.6° | 98.6° |
N1 | C1' | C2' | C3' | 155.3° | 142.8° |
N1 | C1' | C2' | H2' | 39.7° | 24.1° |
C1' | N1 | C6 | H6 | 0.5° | 0.1° |
O4' | C1' | C2' | H1' | 118.3° | 118.9° |
O4' | C1' | C2' | O2' | 161.1° | 142.6° |
O4' | C1' | C2' | C3' | 42.0° | 24.0° |
C1' | O4' | C4' | C3' | 6.8° | 40.5° |
C1' | O4' | C4' | C5' | 128.1° | 159.3° |
C1' | O4' | C4' | H4' | 114.4° | 78.4° |
O4' | C1' | C2' | H2' | 73.6° | 94.7° |
C1' | C2' | O2' | CB' | 59.8° | 153.9° |
C2' | C1' | O4' | C4' | 34.3° | 40.5° |
C1' | C2' | O2' | C3' | 115.7° | 114.6° |
C1' | C2' | O2' | H2' | 127.1° | 122.8° |
C1' | C2' | C3' | H2' | 119.7° | 118.8° |
C1' | C2' | C3' | C4' | 42.1° | 0.0° |
C1' | C2' | C3' | O3' | 76.3° | 118.7° |
C1' | C2' | C3' | H3' | 163.5° | 118.6° |
CG' | CB' | O2' | H12 | 120.0° | 120.0° |
CG' | CB' | O2' | H13 | 120.1° | 120.1° |
CB' | CG' | OD' | H14 | 119.5° | 120.0° |
CB' | CG' | OD' | H15 | 119.5° | 120.0° |
CG' | CB' | O2' | C2' | 74.8° | 180.0° |
CB' | CG' | OD' | CE' | 144.5° | 180.0° |
CG' | CB' | H12 | H13 | 119.9° | 120.0° |
CB' | CG' | H14 | H15 | 121.5° | 119.9° |
O2' | CB' | CG' | OD' | 63.3° | 65.0° |
CB' | O2' | C2' | C3' | 175.5° | 91.5° |
CB' | O2' | C2' | H2' | 67.4° | 31.2° |
O2' | CB' | H12 | H13 | 119.8° | 120.0° |
O2' | CB' | CG' | H14 | 177.2° | 175.0° |
O2' | CB' | CG' | H15 | 56.2° | 55.0° |
O4' | C4' | C3' | C2' | 16.4° | 24.0° |
O4' | C4' | C3' | C5' | 120.5° | 118.9° |
O4' | C4' | C3' | H4' | 118.1° | 119.0° |
O4' | C4' | C5' | H4' | 118.0° | 122.4° |
O4' | C4' | C3' | O3' | 103.1° | 142.7° |
O4' | C4' | C5' | C6' | 95.0° | 9.6° |
O4' | C4' | C5' | H5' | 85.1° | 170.3° |
O4' | C4' | C3' | H3' | 133.8° | 94.6° |
C4' | O4' | C1' | H1' | 87.6° | 78.4° |
OD' | CG' | CB' | H12 | 176.6° | 54.9° |
OD' | CG' | CB' | H13 | 56.7° | 174.9° |
OD' | CG' | H14 | H15 | 121.5° | 120.0° |
CG' | OD' | CE' | H16 | 180.0° | 60.0° |
CG' | OD' | CE' | H17 | 60.0° | 179.9° |
CG' | OD' | CE' | H18 | 60.0° | 60.0° |
O2' | C2' | C3' | H2' | 118.7° | 122.6° |
O2' | C2' | C3' | C4' | 163.7° | 118.6° |
O2' | C2' | C3' | O3' | 45.4° | 0.1° |
O2' | C2' | C3' | H3' | 74.8° | 122.8° |
O2' | C2' | C1' | H1' | 42.8° | 23.7° |
C2' | O2' | CB' | H12 | 45.2° | 60.0° |
C2' | O2' | CB' | H13 | 165.1° | 60.0° |
C2' | C3' | C4' | O3' | 119.6° | 118.7° |
C2' | C3' | C4' | H3' | 117.3° | 118.6° |
C2' | C3' | C4' | C5' | 104.0° | 142.8° |
C2' | C3' | O3' | H3' | 118.7° | 122.7° |
C2' | C3' | C4' | H4' | 134.5° | 95.0° |
C2' | C3' | O3' | HO3' | 180.0° | 176.2° |
C3' | C2' | C1' | H1' | 76.2° | 94.9° |
C3' | C4' | C5' | H4' | 124.5° | 122.2° |
C4' | C3' | O3' | H3' | 125.3° | 122.6° |
C3' | C4' | C5' | C6' | 147.6° | 125.0° |
C3' | C4' | C5' | H5' | 32.4° | 54.9° |
C4' | C3' | O3' | HO3' | 64.1° | 61.5° |
C4' | C3' | C2' | H2' | 77.6° | 118.8° |
C5' | C4' | C3' | O3' | 136.4° | 98.4° |
C4' | C5' | C6' | H5' | 180.0° | 179.9° |
C4' | C5' | C6' | P | 175.6° | 180.0° |
C4' | C5' | C6' | H6' | 4.4° | 0.1° |
C5' | C4' | C3' | H3' | 13.3° | 24.2° |
O3' | C3' | C4' | H4' | 15.0° | 23.7° |
O3' | C3' | C2' | H2' | 164.0° | 122.5° |
CE' | OD' | CG' | H14 | 96.0° | 60.0° |
CE' | OD' | CG' | H15 | 25.0° | 60.0° |
OD' | CE' | H16 | H17 | 120.0° | 120.0° |
OD' | CE' | H16 | H18 | 120.0° | 120.0° |
OD' | CE' | H17 | H18 | 120.0° | 120.1° |
C5' | C6' | P | H6' | 180.0° | 179.9° |
C5' | C6' | P | OP2 | 157.8° | 120.0° |
C5' | C6' | P | OP1 | 36.3° | 0.1° |
C5' | C6' | P | OP3 | 84.7° | 120.0° |
C6' | C5' | C4' | H4' | 23.1° | 112.8° |
C6' | P | OP2 | OP1 | 120.4° | 120.0° |
C6' | P | OP2 | OP3 | 120.6° | 120.0° |
C6' | P | OP1 | OP3 | 122.4° | 120.0° |
C6' | P | OP1 | H1 | 120.1° | 60.0° |
C6' | P | OP3 | HOP3 | 118.7° | 179.9° |
P | C6' | C5' | H5' | 4.3° | 0.1° |
OP2 | P | OP1 | OP3 | 117.5° | 120.0° |
OP2 | P | OP1 | H1 | 0.0° | 180.0° |
OP2 | P | OP3 | HOP3 | 0.0° | 60.0° |
OP2 | P | C6' | H6' | 22.2° | 60.0° |
OP1 | P | OP3 | HOP3 | 120.3° | 60.0° |
OP1 | P | C6' | H6' | 143.7° | 180.0° |
OP3 | P | OP1 | H1 | 117.5° | 60.0° |
OP3 | P | C6' | H6' | 95.3° | 60.0° |
H6' | C6' | C5' | H5' | 175.7° | 180.0° |
H5' | C5' | C4' | H4' | 156.9° | 67.3° |
H4' | C4' | C3' | H3' | 108.1° | 146.4° |
H3' | C3' | O3' | HO3' | 61.2° | 61.1° |
H3' | C3' | C2' | H2' | 43.8° | 0.2° |
H2' | C2' | C1' | H1' | 168.1° | 146.4° |
H12 | CB' | CG' | H14 | 57.2° | 65.0° |
H12 | CB' | CG' | H15 | 63.9° | 175.0° |
H13 | CB' | CG' | H14 | 62.7° | 55.0° |
H13 | CB' | CG' | H15 | 176.2° | 65.0° |
H16 | CE' | H17 | H18 | 120.0° | 120.0° |
H20 | C7 | H21 | H22 | 120.0° | 120.1° |