ODU
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O13 | N12 | doub | 1.22Å | 1.06Å | |
O15 | N14 | doub | 1.22Å | 1.13Å | |
O11 | N09 | sing | 1.22Å | 1.19Å | |
N12 | RU1 | sing | 2.04Å | 1.68Å | |
N14 | O16 | sing | 1.22Å | 1.17Å | |
N14 | RU1 | sing | 2.04Å | 2.07Å | |
N09 | O10 | doub | 1.22Å | 1.14Å | |
N09 | RU1 | sing | 2.04Å | 2.06Å | |
O04 | N03 | doub | 1.22Å | 1.15Å | |
RU1 | N03 | sing | 2.04Å | 2.07Å | |
RU1 | N06 | sing | 2.04Å | 2.08Å | |
RU1 | O01 | sing | 1.84Å | 1.96Å | |
O07 | N06 | sing | 1.22Å | 1.18Å | |
N03 | O05 | sing | 1.22Å | 1.17Å | |
N06 | O08 | doub | 1.22Å | 1.19Å | |
O01 | H1 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O13 | N12 | RU1 | 166.9° | 120.0° |
O15 | N14 | O16 | 114.6° | 120.0° |
O15 | N14 | RU1 | 132.6° | 120.0° |
O11 | N09 | O10 | 122.9° | 120.0° |
O11 | N09 | RU1 | 113.9° | 120.0° |
N12 | RU1 | N14 | 88.2° | 90.0° |
N12 | RU1 | N09 | 99.5° | 90.0° |
N12 | RU1 | N03 | 80.9° | 90.0° |
N12 | RU1 | N06 | 97.6° | 90.0° |
N12 | RU1 | O01 | 170.1° | 180.0° |
O16 | N14 | RU1 | 112.6° | 120.0° |
N14 | RU1 | N09 | 84.2° | 90.0° |
N14 | RU1 | N03 | 167.0° | 180.0° |
N14 | RU1 | N06 | 86.3° | 90.0° |
N14 | RU1 | O01 | 101.3° | 90.0° |
O10 | N09 | RU1 | 122.8° | 120.0° |
N09 | RU1 | N03 | 90.7° | 90.0° |
N09 | RU1 | N06 | 160.1° | 180.0° |
N09 | RU1 | O01 | 84.5° | 90.0° |
O04 | N03 | RU1 | 130.5° | 120.0° |
O04 | N03 | O05 | 117.4° | 120.0° |
N03 | RU1 | N06 | 102.1° | 90.0° |
N03 | RU1 | O01 | 90.1° | 90.0° |
RU1 | N03 | O05 | 111.9° | 120.0° |
N06 | RU1 | O01 | 80.3° | 90.0° |
RU1 | N06 | O07 | 116.7° | 120.0° |
RU1 | N06 | O08 | 117.0° | 120.0° |
RU1 | O01 | H1 | 109.5° | 114.0° |
O07 | N06 | O08 | 125.7° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O13 | N12 | RU1 | N14 | 83.7° | 45.0° |
O13 | N12 | RU1 | N09 | 0.1° | 135.0° |
O13 | N12 | RU1 | N03 | 89.3° | 135.0° |
O13 | N12 | RU1 | N06 | 169.7° | 45.0° |
O13 | N12 | RU1 | O01 | 113.2° | 113.3° |
O15 | N14 | RU1 | N12 | 0.1° | 135.0° |
O15 | N14 | O16 | RU1 | 175.7° | 180.0° |
O15 | N14 | RU1 | N09 | 99.9° | 45.0° |
O15 | N14 | RU1 | N03 | 32.7° | 30.6° |
O15 | N14 | RU1 | N06 | 97.6° | 135.0° |
O15 | N14 | RU1 | O01 | 177.0° | 45.0° |
O11 | N09 | RU1 | N12 | 21.9° | 135.0° |
O11 | N09 | RU1 | N14 | 109.1° | 45.0° |
O11 | N09 | O10 | RU1 | 172.3° | 179.9° |
O11 | N09 | RU1 | N03 | 58.9° | 135.0° |
O11 | N09 | RU1 | N06 | 170.8° | 24.7° |
O11 | N09 | RU1 | O01 | 148.9° | 45.0° |
N12 | RU1 | N14 | O16 | 174.8° | 45.0° |
N12 | RU1 | N14 | N09 | 99.8° | 90.0° |
N12 | RU1 | N14 | N03 | 32.6° | 104.4° |
N12 | RU1 | N14 | N06 | 97.7° | 90.0° |
N12 | RU1 | N14 | O01 | 177.1° | 180.0° |
N12 | RU1 | N09 | O10 | 165.1° | 45.0° |
N12 | RU1 | N09 | N03 | 80.9° | 90.0° |
N12 | RU1 | N09 | N06 | 148.9° | 159.7° |
N12 | RU1 | N09 | O01 | 170.9° | 180.0° |
N12 | RU1 | N03 | O04 | 26.0° | 45.0° |
N12 | RU1 | N03 | N06 | 95.9° | 90.0° |
N12 | RU1 | N03 | O01 | 176.0° | 180.0° |
N12 | RU1 | N06 | O01 | 170.2° | 180.0° |
N12 | RU1 | N06 | O07 | 28.7° | 45.0° |
N12 | RU1 | N03 | O05 | 148.9° | 135.0° |
N12 | RU1 | N06 | O08 | 143.0° | 135.0° |
N12 | RU1 | O01 | H1 | 67.2° | 113.3° |
O16 | N14 | RU1 | N09 | 85.4° | 135.0° |
O16 | N14 | RU1 | N03 | 152.6° | 149.4° |
O16 | N14 | RU1 | N06 | 77.1° | 45.0° |
O16 | N14 | RU1 | O01 | 2.2° | 135.0° |
N14 | RU1 | N09 | O10 | 78.0° | 135.0° |
N14 | RU1 | N09 | N03 | 168.0° | 180.0° |
N14 | RU1 | N09 | N06 | 61.7° | 69.7° |
N14 | RU1 | N09 | O01 | 102.0° | 90.0° |
N14 | RU1 | N03 | O04 | 7.0° | 149.5° |
N14 | RU1 | N03 | N06 | 128.9° | 165.6° |
N14 | RU1 | N03 | O01 | 150.9° | 75.6° |
N14 | RU1 | N06 | O01 | 102.1° | 90.0° |
N14 | RU1 | N06 | O07 | 58.9° | 135.0° |
N14 | RU1 | N03 | O05 | 178.1° | 30.6° |
N14 | RU1 | N06 | O08 | 129.4° | 45.0° |
N14 | RU1 | O01 | H1 | 95.5° | 45.0° |
O10 | N09 | RU1 | N03 | 114.0° | 45.0° |
O10 | N09 | RU1 | N06 | 16.3° | 155.3° |
O10 | N09 | RU1 | O01 | 24.0° | 135.0° |
N09 | RU1 | N03 | O04 | 73.5° | 135.1° |
N09 | RU1 | N03 | N06 | 164.6° | 180.0° |
N09 | RU1 | N03 | O01 | 84.5° | 90.0° |
N09 | RU1 | N06 | O01 | 40.7° | 20.3° |
N09 | RU1 | N06 | O07 | 120.3° | 155.3° |
N09 | RU1 | N03 | O05 | 111.6° | 45.0° |
N09 | RU1 | N06 | O08 | 68.0° | 24.7° |
N09 | RU1 | O01 | H1 | 178.4° | 135.0° |
O04 | N03 | RU1 | O05 | 174.9° | 179.9° |
O04 | N03 | RU1 | N06 | 121.9° | 45.0° |
O04 | N03 | RU1 | O01 | 158.0° | 135.0° |
N03 | RU1 | N06 | O01 | 88.0° | 90.0° |
N03 | RU1 | N06 | O07 | 110.9° | 45.0° |
N03 | RU1 | N06 | O08 | 60.7° | 135.0° |
N03 | RU1 | O01 | H1 | 90.9° | 135.0° |
RU1 | N06 | O07 | O08 | 170.8° | 180.0° |
N06 | RU1 | N03 | O05 | 53.0° | 135.0° |
N06 | RU1 | O01 | H1 | 11.3° | 45.0° |
O01 | RU1 | N06 | O07 | 161.1° | 135.0° |
O01 | RU1 | N03 | O05 | 27.1° | 45.0° |
O01 | RU1 | N06 | O08 | 27.3° | 45.0° |