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8TU

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C21C20sing1.53Å1.54Å
C21C22sing1.53Å1.54Å
C20C14sing1.53Å1.56Å
O13C12sing1.43Å1.38Å
C12C11sing1.53Å1.52Å
C15C14sing1.53Å1.56Å
C15C16sing1.53Å1.54Å
C14C11sing1.53Å1.59Å
C11C10sing1.53Å1.55Å
O18C16sing1.43Å1.41Å
O9C8sing1.43Å1.43Å
C16C17sing1.53Å1.51Å
C16O19sing1.43Å1.43Å
C10C8sing1.53Å1.57Å
C8C7sing1.53Å1.54Å
C7C6sing1.53Å1.53Å
C6C5sing1.53Å1.56Å
C5C4sing1.53Å1.55Å
O3C2doub1.21Å1.25Å
C2O1sing1.34Å1.26Å
C2C4sing1.51Å1.54Å
C12H1sing1.09Å1.10Å
C12H2sing1.09Å1.10Å
C22H3sing1.09Å1.10Å
C22H4sing1.09Å1.10Å
C22H5sing1.09Å1.10Å
O1H6sing0.97Å0.95Å
C4H7sing1.09Å1.10Å
C4H8sing1.09Å1.10Å
C5H9sing1.09Å1.10Å
C5H10sing1.09Å1.10Å
C6H11sing1.09Å1.10Å
C6H12sing1.09Å1.10Å
C7H13sing1.09Å1.10Å
C7H14sing1.09Å1.10Å
C8H15sing1.09Å1.10Å
O9H16sing0.97Å0.95Å
C10H17sing1.09Å1.10Å
C10H18sing1.09Å1.10Å
C11H19sing1.09Å1.10Å
O13H20sing0.97Å0.95Å
C14H21sing1.09Å1.10Å
C15H22sing1.09Å1.10Å
C15H23sing1.09Å1.10Å
C17H24sing1.09Å1.10Å
C17H25sing1.09Å1.10Å
C17H26sing1.09Å1.10Å
O19H27sing0.97Å0.95Å
O18H28sing0.97Å0.95Å
C20H29sing1.09Å1.10Å
C20H30sing1.09Å1.10Å
C21H31sing1.09Å1.10Å
C21H32sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C20C21C22114.3°109.5°
C21C20C14120.9°109.5°
C21C20H29106.6°109.5°
C21C20H30106.5°109.5°
C20C21H31108.3°109.4°
C20C21H32108.2°109.4°
C21C22H3109.5°109.4°
C21C22H4109.4°109.5°
C21C22H5109.4°109.5°
C22C21H31108.3°109.5°
C22C21H32108.3°109.5°
C20C14C15102.5°109.4°
C20C14C11117.6°109.5°
C20C14H21109.1°109.4°
C14C20H29106.6°109.4°
C14C20H30106.6°109.5°
O13C12C11102.7°109.5°
O13C12H1111.1°109.5°
O13C12H2111.2°109.4°
C12O13H20109.5°114.0°
C12C11C14112.5°109.5°
C12C11C10111.6°109.5°
C11C12H1111.2°109.5°
C11C12H2111.2°109.5°
C12C11H19105.6°109.5°
C14C15C16117.8°109.5°
C15C14C11109.5°109.5°
C15C14H21109.2°109.5°
C14C15H22107.3°109.4°
C14C15H23107.3°109.5°
C15C16O18107.8°109.5°
C15C16C17113.6°109.5°
C15C16O19113.9°109.4°
C16C15H22107.4°109.5°
C16C15H23107.4°109.5°
C14C11C10116.0°109.5°
C14C11H19104.8°109.4°
C11C14H21108.7°109.5°
C11C10C8120.5°109.5°
C11C10H17106.6°109.5°
C11C10H18106.7°109.4°
C10C11H19105.2°109.5°
O18C16C17106.8°109.5°
O18C16O19107.1°109.5°
C16O18H28109.5°114.0°
O9C8C10107.5°109.5°
O9C8C7109.6°109.4°
O9C8H15108.4°109.5°
C8O9H16109.5°114.0°
C17C16O19107.2°109.5°
C16C17H24109.5°109.4°
C16C17H25109.5°109.5°
C16C17H26109.5°109.5°
C16O19H27109.5°114.0°
C10C8C7117.2°109.5°
C10C8H15106.7°109.5°
C8C10H17106.7°109.5°
C8C10H18106.6°109.4°
C8C7C6115.1°109.5°
C8C7H13108.0°109.5°
C8C7H14108.0°109.4°
C7C8H15107.1°109.5°
C7C6C5109.1°109.5°
C7C6H11109.5°109.5°
C7C6H12109.6°109.5°
C6C7H13108.0°109.5°
C6C7H14108.0°109.5°
C6C5C4109.8°109.5°
C6C5H9109.4°109.5°
C6C5H10109.4°109.4°
C5C6H11109.6°109.5°
C5C6H12109.6°109.4°
C5C4C2114.2°109.5°
C5C4H7108.3°109.5°
C5C4H8108.3°109.5°
C4C5H9109.4°109.6°
C4C5H10109.4°109.5°
O3C2O1125.2°120.0°
O3C2C4118.1°120.0°
O1C2C4116.7°120.0°
C2O1H6109.5°117.0°
C2C4H7108.3°109.4°
C2C4H8108.3°109.5°
H1C12H2109.4°109.5°
H3C22H4109.5°109.5°
H3C22H5109.5°109.5°
H4C22H5109.5°109.5°
H7C4H8109.5°109.5°
H9C5H10109.5°109.4°
H11C6H12109.5°109.5°
H13C7H14109.5°109.4°
H17C10H18109.4°109.5°
H22C15H23109.5°109.4°
H24C17H25109.5°109.5°
H24C17H26109.5°109.5°
H25C17H26109.5°109.5°
H29C20H30109.5°109.4°
H31C21H32109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C20C21C22H31120.7°120.0°
C20C21C22H32120.7°120.0°
C21C20C14H29121.6°120.0°
C21C20C14H30121.6°120.1°
C21C20C14C15174.9°64.7°
C21C20C14C1154.8°175.4°
C20C21C22H3180.0°60.0°
C20C21C22H460.0°180.0°
C20C21C22H560.0°60.0°
C21C20C14H2169.5°55.3°
C21C20H29H30114.8°120.0°
C20C21H31H32117.8°119.9°
C22C21C20C1428.3°180.0°
C21C22H3H4120.0°120.0°
C21C22H3H5120.0°120.0°
C21C22H4H5119.9°120.0°
C22C21C20H2993.3°60.0°
C22C21C20H30149.9°60.0°
C22C21H31H32117.8°120.1°
C20C14C11C1219.6°53.2°
C20C14C15C11125.6°120.0°
C20C14C15H21115.6°119.9°
C20C14C15C16155.2°79.2°
C20C14C11H21124.5°120.0°
C20C14C11C10110.6°173.3°
C20C14C11H19133.9°66.7°
C20C14C15H2234.0°160.7°
C20C14C15H2383.6°40.8°
C14C20H29H30114.9°120.0°
C14C20C21H3192.4°59.9°
C14C20C21H32149.0°60.0°
O13C12C11H1118.9°120.0°
O13C12C11H2118.9°119.9°
O13C12C11C1496.1°172.7°
O13C12C11C10131.5°67.3°
O13C12H1H2123.1°120.0°
O13C12C11H1917.7°52.7°
C12C11C14C1596.8°173.2°
C12C11C14C10130.2°120.1°
C12C11C14H19114.2°120.0°
C12C11C10H19114.1°120.0°
C12C11C10C867.4°64.8°
C11C12H1H2123.2°120.0°
C12C11C10H1754.2°175.2°
C12C11C10H18171.1°55.2°
C11C12O13H20180.0°180.0°
C12C11C14H21144.1°66.8°
C14C15C16H22121.2°120.0°
C14C15C16H23121.2°120.0°
C15C14C11H21119.2°120.0°
C15C14C11C10133.1°66.8°
C14C15C16O18168.6°173.8°
C14C15C16C1773.2°53.8°
C14C15C16O1950.0°66.3°
C15C14C11H1917.5°53.2°
C14C15H22H23116.2°120.0°
C15C14C20H2963.5°175.4°
C15C14C20H3053.3°55.4°
C16C15C14C1179.2°40.8°
C15C16O18C17122.4°120.0°
C15C16O18O19123.0°119.9°
C15C16C17O19126.8°120.0°
C16C15C14H2139.7°160.8°
C16C15H22H23116.3°120.0°
C15C16C17H24180.0°70.7°
C15C16C17H2560.0°169.3°
C15C16C17H2660.0°49.3°
C15C16O19H27180.0°60.0°
C15C16O18H28180.0°180.0°
C14C11C10H19115.3°120.0°
C14C11C10C8162.0°175.2°
C14C11C12H1145.0°52.7°
C14C11C12H222.9°67.4°
C14C11C10H1776.4°55.2°
C14C11C10H1840.5°64.9°
C11C14C15H22159.6°79.3°
C11C14C15H2342.0°160.8°
C11C14C20H29176.4°55.4°
C11C14C20H3066.8°64.6°
C11C10C8O987.3°60.4°
C11C10C8H17121.5°120.1°
C11C10C8H18121.6°119.9°
C11C10C8C736.6°179.7°
C10C11C12H112.6°172.7°
C10C11C12H2109.6°52.7°
C11C10C8H15156.6°59.7°
C11C10H17H18115.0°120.0°
C10C11C14H2113.9°53.3°
O18C16C17O19114.5°120.0°
O18C16C15H2247.5°66.2°
O18C16C15H2370.2°53.7°
O18C16C17H2461.3°169.3°
O18C16C17H2558.7°49.4°
O18C16C17H26178.7°70.7°
O18C16O19H2760.9°60.0°
O9C8C10C7123.9°120.0°
O9C8C10H15116.1°120.0°
O9C8C7H15117.4°120.0°
O9C8C7C693.9°65.0°
O9C8C7H13145.3°55.1°
O9C8C7H1426.9°175.0°
O9C8C10H1734.2°59.7°
O9C8C10H18151.1°179.7°
C17C16C15H22165.6°173.8°
C17C16C15H2348.0°66.3°
C16C17H24H25120.0°120.0°
C16C17H24H26120.0°120.0°
C16C17H25H26120.0°120.0°
C17C16O19H2753.4°180.0°
C17C16O18H2857.6°60.0°
O19C16C15H2271.2°53.7°
O19C16C15H23171.2°173.7°
O19C16C17H2453.2°49.3°
O19C16C17H25173.2°70.6°
O19C16C17H2666.8°169.3°
O19C16O18H2857.0°60.0°
C10C8C7H15119.8°120.0°
C10C8C7C6143.3°175.0°
C10C8C7H1322.5°64.9°
C10C8C7H1495.9°55.0°
C10C8O9H16180.0°60.0°
C8C10H17H18115.0°120.0°
C8C10C11H1946.7°55.2°
C8C7C6H13120.8°120.1°
C8C7C6H14120.8°120.0°
C8C7C6C5157.9°180.0°
C8C7C6H1182.2°60.0°
C8C7C6H1237.9°60.0°
C8C7H13H14117.4°120.0°
C7C8O9H1651.6°60.0°
C7C8C10H17158.1°60.3°
C7C8C10H1885.0°59.7°
C7C6C5H11119.9°120.0°
C7C6C5H12120.0°120.0°
C7C6C5C484.2°180.0°
C7C6C5H935.8°59.9°
C7C6C5H10155.7°60.0°
C7C6H11H12120.1°120.0°
C6C7H13H14117.4°120.0°
C6C7C8H1523.5°55.0°
C6C5C4H9120.0°120.0°
C6C5C4H10120.1°120.0°
C6C5C4C2141.2°180.0°
C6C5C4H798.1°60.0°
C6C5C4H820.5°60.0°
C6C5H9H10119.9°119.9°
C5C6H11H12120.2°120.0°
C5C6C7H1337.1°59.9°
C5C6C7H1481.3°60.0°
C5C4C2O334.6°0.3°
C5C4C2O1147.7°180.0°
C5C4C2H7120.7°120.0°
C5C4C2H8120.7°120.0°
C5C4H7H8117.8°120.1°
C4C5H9H10119.8°120.0°
C4C5C6H11155.8°60.0°
C4C5C6H1235.7°60.0°
O3C2O1C4177.5°179.7°
O3C2O1H60.0°0.3°
O3C2C4H786.1°119.7°
O3C2C4H8155.3°120.3°
O1C2C4H791.6°60.0°
O1C2C4H827.0°60.0°
C4C2O1H6177.4°180.0°
C2C4H7H8117.8°120.0°
C2C4C5H921.1°60.0°
C2C4C5H1098.7°60.0°
H1C12C11H19101.2°67.2°
H1C12O13H2061.1°60.0°
H2C12C11H19136.6°172.7°
H2C12O13H2061.1°60.1°
H3C22H4H5120.0°120.0°
H3C22C21H3159.3°180.0°
H3C22C21H3259.3°60.0°
H4C22C21H31179.3°60.1°
H4C22C21H3260.7°60.0°
H5C22C21H3160.7°60.0°
H5C22C21H32179.3°180.0°
H7C4C5H9141.9°179.9°
H7C4C5H1022.0°59.9°
H8C4C5H999.5°60.0°
H8C4C5H10140.6°180.0°
H9C5C6H1184.2°179.9°
H9C5C6H12155.7°60.1°
H10C5C6H1135.8°60.0°
H10C5C6H1284.3°180.0°
H11C6C7H13157.0°179.9°
H11C6C7H1438.7°60.0°
H12C6C7H1382.9°60.0°
H12C6C7H14158.7°180.0°
H13C7C8H1597.3°175.0°
H14C7C8H15144.4°65.0°
H15C8O9H1665.0°180.0°
H15C8C10H1781.9°179.7°
H15C8C10H1835.0°60.3°
H17C10C11H19168.2°64.8°
H18C10C11H1974.9°175.2°
H19C11C14H21101.7°173.2°
H21C14C15H2281.5°40.8°
H21C14C15H23160.9°79.2°
H21C14C20H2952.1°64.7°
H21C14C20H30168.9°175.4°
H24C17H25H26120.0°120.0°
H29C20C21H31146.0°60.0°
H29C20C21H3227.4°180.0°
H30C20C21H3129.2°180.0°
H30C20C21H3289.4°60.1°

222624

PDB entries from 2024-07-17

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