6W5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C26 | C01 | doub | 1.33Å | 1.32Å | |
| C01 | C02 | sing | 1.47Å | 1.53Å | |
| C02 | O25 | doub | 1.22Å | 1.18Å | |
| C02 | N03 | sing | 1.35Å | 1.46Å | |
| C18 | C13 | sing | 1.53Å | 1.54Å | |
| N03 | C04 | sing | 1.46Å | 1.46Å | |
| C19 | C13 | sing | 1.53Å | 1.52Å | |
| C13 | C14 | sing | 1.53Å | 1.51Å | |
| C13 | C12 | sing | 1.53Å | 1.53Å | |
| C04 | C05 | sing | 1.53Å | 1.53Å | |
| O22 | C12 | sing | 1.43Å | 1.40Å | |
| C14 | O15 | sing | 1.43Å | 1.41Å | |
| N10 | C09 | sing | 1.46Å | 1.44Å | |
| N10 | C11 | sing | 1.35Å | 1.45Å | |
| C12 | C11 | sing | 1.51Å | 1.52Å | |
| O24 | C07 | doub | 1.21Å | 1.18Å | |
| C05 | N06 | sing | 1.46Å | 1.45Å | |
| C09 | C08 | sing | 1.53Å | 1.53Å | |
| C11 | O23 | doub | 1.21Å | 1.18Å | |
| O15 | P16 | sing | 1.61Å | 1.65Å | |
| C07 | N06 | sing | 1.35Å | 1.45Å | |
| C07 | C08 | sing | 1.51Å | 1.53Å | |
| P16 | O17 | doub | 1.48Å | 1.43Å | |
| P16 | O20 | sing | 1.61Å | 1.47Å | |
| P16 | O1 | sing | 1.61Å | 1.68Å | |
| C26 | H1 | sing | 1.08Å | 1.08Å | |
| C26 | H2 | sing | 1.08Å | 1.08Å | |
| C01 | H3 | sing | 1.08Å | 1.08Å | |
| N03 | H4 | sing | 0.97Å | 1.00Å | |
| C04 | H5 | sing | 1.09Å | 1.10Å | |
| C04 | H6 | sing | 1.09Å | 1.10Å | |
| C05 | H7 | sing | 1.09Å | 1.10Å | |
| C05 | H8 | sing | 1.09Å | 1.10Å | |
| N06 | H9 | sing | 0.97Å | 1.00Å | |
| C08 | H10 | sing | 1.09Å | 1.10Å | |
| C08 | H11 | sing | 1.09Å | 1.10Å | |
| C09 | H12 | sing | 1.09Å | 1.10Å | |
| C09 | H13 | sing | 1.09Å | 1.10Å | |
| N10 | H14 | sing | 0.97Å | 1.00Å | |
| C12 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H19 | sing | 1.09Å | 1.10Å | |
| C18 | H20 | sing | 1.09Å | 1.10Å | |
| C19 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| O20 | H24 | sing | 0.97Å | 0.95Å | |
| O22 | H25 | sing | 0.97Å | 0.95Å | |
| O1 | H26 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C26 | C01 | C02 | 119.0° | 120.0° |
| C01 | C26 | H1 | 120.0° | 120.0° |
| C01 | C26 | H2 | 120.0° | 120.0° |
| C26 | C01 | H3 | 120.5° | 120.0° |
| C01 | C02 | O25 | 119.9° | 120.0° |
| C01 | C02 | N03 | 119.5° | 120.0° |
| C02 | C01 | H3 | 120.5° | 120.0° |
| O25 | C02 | N03 | 120.5° | 120.0° |
| C02 | N03 | C04 | 120.9° | 120.0° |
| C02 | N03 | H4 | 119.6° | 120.0° |
| C18 | C13 | C19 | 109.9° | 109.5° |
| C18 | C13 | C14 | 110.8° | 109.5° |
| C18 | C13 | C12 | 110.4° | 109.5° |
| C13 | C18 | H18 | 109.5° | 109.4° |
| C13 | C18 | H19 | 109.5° | 109.5° |
| C13 | C18 | H20 | 109.5° | 109.4° |
| N03 | C04 | C05 | 111.5° | 109.5° |
| C04 | N03 | H4 | 119.5° | 120.0° |
| N03 | C04 | H5 | 108.9° | 109.5° |
| N03 | C04 | H6 | 108.9° | 109.5° |
| C19 | C13 | C14 | 107.0° | 109.5° |
| C19 | C13 | C12 | 108.7° | 109.5° |
| C13 | C19 | H21 | 109.5° | 109.5° |
| C13 | C19 | H22 | 109.5° | 109.4° |
| C13 | C19 | H23 | 109.4° | 109.5° |
| C14 | C13 | C12 | 109.9° | 109.4° |
| C13 | C14 | O15 | 113.6° | 109.4° |
| C13 | C14 | H16 | 108.4° | 109.4° |
| C13 | C14 | H17 | 108.4° | 109.5° |
| C13 | C12 | O22 | 107.8° | 109.5° |
| C13 | C12 | C11 | 110.7° | 109.4° |
| C13 | C12 | H15 | 109.2° | 109.4° |
| C04 | C05 | N06 | 109.9° | 109.5° |
| C05 | C04 | H5 | 109.0° | 109.4° |
| C05 | C04 | H6 | 109.0° | 109.5° |
| C04 | C05 | H7 | 109.4° | 109.4° |
| C04 | C05 | H8 | 109.4° | 109.5° |
| O22 | C12 | C11 | 108.7° | 109.5° |
| O22 | C12 | H15 | 111.1° | 109.5° |
| C12 | O22 | H25 | 109.5° | 114.0° |
| C14 | O15 | P16 | 117.4° | 123.0° |
| O15 | C14 | H16 | 108.5° | 109.4° |
| O15 | C14 | H17 | 108.5° | 109.5° |
| C09 | N10 | C11 | 119.3° | 120.0° |
| N10 | C09 | C08 | 110.6° | 109.5° |
| N10 | C09 | H12 | 109.2° | 109.5° |
| N10 | C09 | H13 | 109.2° | 109.5° |
| C09 | N10 | H14 | 120.4° | 120.1° |
| N10 | C11 | C12 | 118.7° | 120.0° |
| N10 | C11 | O23 | 120.4° | 120.0° |
| C11 | N10 | H14 | 120.4° | 120.0° |
| C12 | C11 | O23 | 120.9° | 120.0° |
| C11 | C12 | H15 | 109.3° | 109.5° |
| O24 | C07 | N06 | 120.2° | 120.0° |
| O24 | C07 | C08 | 120.2° | 120.0° |
| C05 | N06 | C07 | 119.4° | 120.0° |
| N06 | C05 | H7 | 109.4° | 109.5° |
| N06 | C05 | H8 | 109.4° | 109.5° |
| C05 | N06 | H9 | 120.3° | 120.0° |
| C09 | C08 | C07 | 110.8° | 109.5° |
| C09 | C08 | H10 | 109.1° | 109.4° |
| C09 | C08 | H11 | 109.2° | 109.5° |
| C08 | C09 | H12 | 109.2° | 109.4° |
| C08 | C09 | H13 | 109.2° | 109.5° |
| O15 | P16 | O17 | 114.8° | 109.5° |
| O15 | P16 | O20 | 121.4° | 109.5° |
| O15 | P16 | O1 | 97.4° | 109.5° |
| N06 | C07 | C08 | 119.6° | 120.0° |
| C07 | N06 | H9 | 120.3° | 120.0° |
| C07 | C08 | H10 | 109.1° | 109.5° |
| C07 | C08 | H11 | 109.1° | 109.5° |
| O17 | P16 | O20 | 114.9° | 109.5° |
| O17 | P16 | O1 | 91.0° | 109.5° |
| O20 | P16 | O1 | 110.8° | 109.5° |
| P16 | O20 | H24 | 109.5° | 114.0° |
| P16 | O1 | H26 | 109.5° | 114.0° |
| H1 | C26 | H2 | 120.0° | 120.1° |
| H5 | C04 | H6 | 109.5° | 109.5° |
| H7 | C05 | H8 | 109.5° | 109.5° |
| H10 | C08 | H11 | 109.5° | 109.5° |
| H12 | C09 | H13 | 109.5° | 109.5° |
| H16 | C14 | H17 | 109.5° | 109.6° |
| H18 | C18 | H19 | 109.5° | 109.5° |
| H18 | C18 | H20 | 109.4° | 109.5° |
| H19 | C18 | H20 | 109.5° | 109.5° |
| H21 | C19 | H22 | 109.5° | 109.4° |
| H21 | C19 | H23 | 109.5° | 109.5° |
| H22 | C19 | H23 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C26 | C01 | C02 | H3 | 180.0° | 180.0° |
| C26 | C01 | C02 | O25 | 62.0° | 0.0° |
| C26 | C01 | C02 | N03 | 118.0° | 180.0° |
| C01 | C26 | H1 | H2 | 180.0° | 180.0° |
| C01 | C02 | O25 | N03 | 180.0° | 179.9° |
| C01 | C02 | N03 | C04 | 179.6° | 180.0° |
| C02 | C01 | C26 | H1 | 0.0° | 0.0° |
| C02 | C01 | C26 | H2 | 180.0° | 180.0° |
| C01 | C02 | N03 | H4 | 0.4° | 0.0° |
| O25 | C02 | N03 | C04 | 0.4° | 0.0° |
| O25 | C02 | C01 | H3 | 118.0° | 180.0° |
| O25 | C02 | N03 | H4 | 179.6° | 179.9° |
| C02 | N03 | C04 | H4 | 180.0° | 180.0° |
| C02 | N03 | C04 | C05 | 71.9° | 180.0° |
| N03 | C02 | C01 | H3 | 62.0° | 0.0° |
| C02 | N03 | C04 | H5 | 167.8° | 60.0° |
| C02 | N03 | C04 | H6 | 48.4° | 60.0° |
| C18 | C13 | C19 | C14 | 120.4° | 120.0° |
| C18 | C13 | C19 | C12 | 120.9° | 120.0° |
| C18 | C13 | C14 | C12 | 122.3° | 120.0° |
| C18 | C13 | C12 | O22 | 77.4° | 66.0° |
| C18 | C13 | C14 | O15 | 175.5° | 60.0° |
| C18 | C13 | C12 | C11 | 41.4° | 54.1° |
| C18 | C13 | C12 | H15 | 161.9° | 174.0° |
| C18 | C13 | C14 | H16 | 54.9° | 180.0° |
| C18 | C13 | C14 | H17 | 63.9° | 60.0° |
| C13 | C18 | H18 | H19 | 120.0° | 120.0° |
| C13 | C18 | H18 | H20 | 120.0° | 120.0° |
| C13 | C18 | H19 | H20 | 120.0° | 120.0° |
| C18 | C13 | C19 | H21 | 180.0° | 64.3° |
| C18 | C13 | C19 | H22 | 60.0° | 55.6° |
| C18 | C13 | C19 | H23 | 60.0° | 175.6° |
| N03 | C04 | C05 | H5 | 120.3° | 120.0° |
| N03 | C04 | C05 | H6 | 120.3° | 120.1° |
| N03 | C04 | C05 | N06 | 70.2° | 180.0° |
| N03 | C04 | H5 | H6 | 119.0° | 120.0° |
| N03 | C04 | C05 | H7 | 169.8° | 60.0° |
| N03 | C04 | C05 | H8 | 49.9° | 59.9° |
| C19 | C13 | C14 | C12 | 117.9° | 120.0° |
| C19 | C13 | C12 | O22 | 43.3° | 174.0° |
| C19 | C13 | C14 | O15 | 55.7° | 60.0° |
| C19 | C13 | C12 | C11 | 162.0° | 65.9° |
| C19 | C13 | C12 | H15 | 77.5° | 54.0° |
| C19 | C13 | C14 | H16 | 64.9° | 59.9° |
| C19 | C13 | C14 | H17 | 176.3° | 180.0° |
| C19 | C13 | C18 | H18 | 180.0° | 180.0° |
| C19 | C13 | C18 | H19 | 60.0° | 60.0° |
| C19 | C13 | C18 | H20 | 60.0° | 60.0° |
| C13 | C19 | H21 | H22 | 120.0° | 119.9° |
| C13 | C19 | H21 | H23 | 120.0° | 120.0° |
| C13 | C19 | H22 | H23 | 120.0° | 120.0° |
| C14 | C13 | C12 | O22 | 160.1° | 54.0° |
| C13 | C14 | O15 | H16 | 120.6° | 119.9° |
| C13 | C14 | O15 | H17 | 120.6° | 120.0° |
| C14 | C13 | C12 | C11 | 81.1° | 174.1° |
| C13 | C14 | O15 | P16 | 152.8° | 180.0° |
| C14 | C13 | C12 | H15 | 39.3° | 66.0° |
| C13 | C14 | H16 | H17 | 118.1° | 120.0° |
| C14 | C13 | C18 | H18 | 61.9° | 60.0° |
| C14 | C13 | C18 | H19 | 58.1° | 180.0° |
| C14 | C13 | C18 | H20 | 178.1° | 60.0° |
| C14 | C13 | C19 | H21 | 59.6° | 55.7° |
| C14 | C13 | C19 | H22 | 179.6° | 175.6° |
| C14 | C13 | C19 | H23 | 60.4° | 64.4° |
| C13 | C12 | O22 | C11 | 120.0° | 120.0° |
| C13 | C12 | O22 | H15 | 119.6° | 119.9° |
| C12 | C13 | C14 | O15 | 62.2° | 180.0° |
| C13 | C12 | C11 | N10 | 115.4° | 108.3° |
| C13 | C12 | C11 | H15 | 120.4° | 119.9° |
| C13 | C12 | C11 | O23 | 66.6° | 71.8° |
| C12 | C13 | C14 | H16 | 177.2° | 60.1° |
| C12 | C13 | C14 | H17 | 58.4° | 60.0° |
| C12 | C13 | C18 | H18 | 60.1° | 60.0° |
| C12 | C13 | C18 | H19 | 179.9° | 60.0° |
| C12 | C13 | C18 | H20 | 59.9° | 180.0° |
| C12 | C13 | C19 | H21 | 59.1° | 175.7° |
| C12 | C13 | C19 | H22 | 61.0° | 64.4° |
| C12 | C13 | C19 | H23 | 179.0° | 55.6° |
| C13 | C12 | O22 | H25 | 180.0° | 60.0° |
| C04 | C05 | N06 | H7 | 120.1° | 120.0° |
| C04 | C05 | N06 | H8 | 120.1° | 120.1° |
| C04 | C05 | N06 | C07 | 127.9° | 180.0° |
| C05 | C04 | N03 | H4 | 108.1° | 0.1° |
| C05 | C04 | H5 | H6 | 119.1° | 120.0° |
| C04 | C05 | H7 | H8 | 119.8° | 120.0° |
| C04 | C05 | N06 | H9 | 52.1° | 0.1° |
| O22 | C12 | C11 | N10 | 2.8° | 11.7° |
| O22 | C12 | C11 | H15 | 121.4° | 120.1° |
| O22 | C12 | C11 | O23 | 175.2° | 168.2° |
| C14 | O15 | P16 | O17 | 39.2° | 55.0° |
| C14 | O15 | P16 | O20 | 175.1° | 65.0° |
| C14 | O15 | P16 | O1 | 55.3° | 175.0° |
| O15 | C14 | H16 | H17 | 118.2° | 120.1° |
| C09 | N10 | C11 | H14 | 180.0° | 180.0° |
| C09 | N10 | C11 | C12 | 178.9° | 174.9° |
| N10 | C09 | C08 | H12 | 120.2° | 120.0° |
| N10 | C09 | C08 | H13 | 120.2° | 120.0° |
| C09 | N10 | C11 | O23 | 0.9° | 5.1° |
| N10 | C09 | C08 | C07 | 110.2° | 180.0° |
| N10 | C09 | C08 | H10 | 9.9° | 60.0° |
| N10 | C09 | C08 | H11 | 129.6° | 59.9° |
| N10 | C09 | H12 | H13 | 119.5° | 120.0° |
| N10 | C11 | C12 | O23 | 178.0° | 180.0° |
| C11 | N10 | C09 | C08 | 116.4° | 180.0° |
| C11 | N10 | C09 | H12 | 3.8° | 60.0° |
| C11 | N10 | C09 | H13 | 123.5° | 60.0° |
| N10 | C11 | C12 | H15 | 124.2° | 131.8° |
| C12 | C11 | N10 | H14 | 1.1° | 5.1° |
| C11 | C12 | O22 | H25 | 59.9° | 60.0° |
| O24 | C07 | N06 | C05 | 0.2° | 0.0° |
| O24 | C07 | C08 | C09 | 86.5° | 0.0° |
| O24 | C07 | N06 | C08 | 179.8° | 180.0° |
| O24 | C07 | N06 | H9 | 179.8° | 180.0° |
| O24 | C07 | C08 | H10 | 33.7° | 120.0° |
| O24 | C07 | C08 | H11 | 153.3° | 120.0° |
| C05 | N06 | C07 | H9 | 180.0° | 179.9° |
| C05 | N06 | C07 | C08 | 180.0° | 180.0° |
| N06 | C05 | C04 | H5 | 50.1° | 60.0° |
| N06 | C05 | C04 | H6 | 169.5° | 59.9° |
| N06 | C05 | H7 | H8 | 119.8° | 120.0° |
| C09 | C08 | C07 | N06 | 93.4° | 180.0° |
| C09 | C08 | C07 | H10 | 120.2° | 120.0° |
| C09 | C08 | C07 | H11 | 120.2° | 120.0° |
| C09 | C08 | H10 | H11 | 119.4° | 120.0° |
| C08 | C09 | H12 | H13 | 119.4° | 120.1° |
| C08 | C09 | N10 | H14 | 63.7° | 0.1° |
| O23 | C11 | N10 | H14 | 179.1° | 174.8° |
| O23 | C11 | C12 | H15 | 53.8° | 48.2° |
| O15 | P16 | O17 | O20 | 147.9° | 120.0° |
| O15 | P16 | O17 | O1 | 98.6° | 120.0° |
| O15 | P16 | O20 | O1 | 113.1° | 120.0° |
| P16 | O15 | C14 | H16 | 86.6° | 60.1° |
| P16 | O15 | C14 | H17 | 32.2° | 60.0° |
| O15 | P16 | O20 | H24 | 145.6° | 60.0° |
| O15 | P16 | O1 | H26 | 115.2° | 180.0° |
| C07 | N06 | C05 | H7 | 112.0° | 60.0° |
| C07 | N06 | C05 | H8 | 7.8° | 60.0° |
| N06 | C07 | C08 | H10 | 146.5° | 60.0° |
| N06 | C07 | C08 | H11 | 26.8° | 60.0° |
| C08 | C07 | N06 | H9 | 0.0° | 0.0° |
| C07 | C08 | H10 | H11 | 119.4° | 120.0° |
| C07 | C08 | C09 | H12 | 129.6° | 60.0° |
| C07 | C08 | C09 | H13 | 10.0° | 60.0° |
| O17 | P16 | O20 | O1 | 101.3° | 120.0° |
| O17 | P16 | O20 | H24 | 0.0° | 180.0° |
| O17 | P16 | O1 | H26 | 0.0° | 60.0° |
| O20 | P16 | O1 | H26 | 117.1° | 60.1° |
| O1 | P16 | O20 | H24 | 101.3° | 60.0° |
| H1 | C26 | C01 | H3 | 180.0° | 180.0° |
| H2 | C26 | C01 | H3 | 0.0° | 0.0° |
| H4 | N03 | C04 | H5 | 12.2° | 120.0° |
| H4 | N03 | C04 | H6 | 131.5° | 120.0° |
| H5 | C04 | C05 | H7 | 70.0° | 180.0° |
| H5 | C04 | C05 | H8 | 170.2° | 60.0° |
| H6 | C04 | C05 | H7 | 49.5° | 60.0° |
| H6 | C04 | C05 | H8 | 70.4° | 180.0° |
| H7 | C05 | N06 | H9 | 67.9° | 120.0° |
| H8 | C05 | N06 | H9 | 172.2° | 120.0° |
| H10 | C08 | C09 | H12 | 110.2° | 180.0° |
| H10 | C08 | C09 | H13 | 130.1° | 60.0° |
| H11 | C08 | C09 | H12 | 9.4° | 60.0° |
| H11 | C08 | C09 | H13 | 110.2° | 180.0° |
| H12 | C09 | N10 | H14 | 176.1° | 120.0° |
| H13 | C09 | N10 | H14 | 56.5° | 120.0° |
| H15 | C12 | O22 | H25 | 60.4° | 180.0° |
| H18 | C18 | H19 | H20 | 120.0° | 120.0° |
| H21 | C19 | H22 | H23 | 120.0° | 120.1° |
