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E4R

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O3C3sing1.43Å1.44Å
C3C4sing1.53Å1.55Å
C3C2sing1.53Å1.55Å
C4C5sing1.53Å1.56Å
C5C6sing1.53Å1.55Å
C5C10sing1.53Å1.57Å
C2C1sing1.53Å1.55Å
C1C10sing1.53Å1.57Å
C6C7sing1.53Å1.55Å
C19C10sing1.53Å1.57Å
C10C9sing1.53Å1.58Å
C7C8sing1.53Å1.56Å
C9C8sing1.53Å1.57Å
C9C11sing1.53Å1.56Å
C8C14sing1.51Å1.57Å
C11C12sing1.53Å1.55Å
C14C15sing1.54Å1.56Å
C14O14sing1.43Å1.44Å
C14C13sing1.54Å1.56Å
C15C16sing1.55Å1.56Å
C12C13sing1.53Å1.56Å
C13C18sing1.53Å1.56Å
C13C17sing1.55Å1.57Å
C16C17sing1.54Å1.56Å
C17O2sing1.43Å1.44Å
C17C20sing1.51Å1.52Å
C22C20doub1.34Å1.34ÅAromatic
C22O23sing1.34Å1.34ÅAromatic
C20C21sing1.41Å1.46ÅAromatic
O23C24sing1.34Å1.34ÅAromatic
C21C24doub1.34Å1.33ÅAromatic
C1H1sing1.09Å1.10Å
C1H2sing1.09Å1.10Å
C2H3sing1.09Å1.10Å
C2H4sing1.09Å1.10Å
C3H5sing1.09Å1.10Å
O2H6sing0.97Å0.95Å
C4H7sing1.09Å1.10Å
C4H8sing1.09Å1.10Å
C5H9sing1.09Å1.10Å
C6H10sing1.09Å1.10Å
C6H11sing1.09Å1.10Å
C7H12sing1.09Å1.10Å
C7H13sing1.09Å1.10Å
C8H14sing1.09Å1.10Å
C9H15sing1.09Å1.10Å
C11H16sing1.09Å1.10Å
C11H17sing1.09Å1.10Å
C12H18sing1.09Å1.10Å
C12H19sing1.09Å1.10Å
C15H20sing1.09Å1.10Å
C15H21sing1.09Å1.10Å
C16H22sing1.09Å1.10Å
C16H23sing1.09Å1.10Å
C18H24sing1.09Å1.10Å
C18H25sing1.09Å1.10Å
C18H26sing1.09Å1.10Å
C19H27sing1.09Å1.10Å
C19H28sing1.09Å1.10Å
C19H29sing1.09Å1.10Å
C21H30sing1.08Å1.08Å
C22H31sing1.08Å1.08Å
C24H32sing1.08Å1.08Å
O14H33sing0.97Å0.95Å
O3H34sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O3C3C4111.2°109.5°
O3C3C2108.8°109.5°
O3C3H5110.3°109.5°
C3O3H34109.5°114.0°
C4C3C2108.9°109.5°
C3C4C5111.1°109.5°
C4C3H5108.8°109.5°
C3C4H7109.1°109.5°
C3C4H8109.1°109.5°
C3C2C1109.6°109.5°
C3C2H3109.4°109.5°
C3C2H4109.4°109.5°
C2C3H5108.8°109.5°
C4C5C6110.9°109.5°
C4C5C10113.6°109.5°
C5C4H7109.1°109.5°
C5C4H8109.1°109.4°
C4C5H9106.7°109.4°
C6C5C10111.8°109.5°
C5C6C7112.0°109.5°
C6C5H9106.8°109.4°
C5C6H10108.8°109.5°
C5C6H11108.8°109.4°
C5C10C1106.6°109.5°
C5C10C19110.0°109.4°
C5C10C9109.5°109.5°
C10C5H9106.6°109.4°
C2C1C10115.1°109.4°
C2C1H1108.1°109.4°
C2C1H2108.1°109.5°
C1C2H3109.4°109.5°
C1C2H4109.5°109.5°
C1C10C19104.7°109.5°
C1C10C9114.4°109.5°
C10C1H1108.0°109.5°
C10C1H2108.1°109.5°
C6C7C8111.6°109.5°
C7C6H10108.8°109.5°
C7C6H11108.8°109.5°
C6C7H12108.9°109.5°
C6C7H13108.9°109.4°
C19C10C9111.4°109.4°
C10C19H27109.5°109.5°
C10C19H28109.5°109.5°
C10C19H29109.5°109.4°
C10C9C8113.6°109.5°
C10C9C11114.0°109.3°
C10C9H15106.5°110.2°
C7C8C9111.0°109.5°
C7C8C14111.4°110.5°
C8C7H12108.9°109.5°
C8C7H13108.9°109.5°
C7C8H14106.4°108.6°
C8C9C11108.9°108.5°
C9C8C14114.9°111.7°
C9C8H14106.3°107.7°
C8C9H15106.6°109.7°
C9C11C12111.5°108.6°
C11C9H15106.7°109.7°
C9C11H16109.0°109.6°
C9C11H17109.0°109.7°
C8C14C15115.9°112.7°
C8C14O14108.2°109.2°
C8C14C13113.9°113.7°
C14C8H14106.3°108.6°
C11C12C13114.3°110.7°
C12C11H16109.0°109.6°
C12C11H17108.9°109.6°
C11C12H18108.3°109.2°
C11C12H19108.2°109.2°
C15C14O14108.4°109.1°
C15C14C13104.3°103.5°
C14C15C16106.7°103.5°
C14C15H20110.1°110.6°
C14C15H21110.1°110.6°
O14C14C13105.6°108.5°
C14O14H33109.5°114.0°
C14C13C12109.4°110.7°
C14C13C18113.6°112.5°
C14C13C17103.1°103.0°
C15C16C17106.7°106.6°
C16C15H20110.2°110.6°
C16C15H21110.2°110.6°
C15C16H22110.2°110.1°
C15C16H23110.2°110.1°
C12C13C18109.0°111.6°
C12C13C17109.8°106.7°
C13C12H18108.2°109.3°
C13C12H19108.3°109.3°
C18C13C17111.8°111.8°
C13C18H24109.5°109.5°
C13C18H25109.5°109.4°
C13C18H26109.5°109.4°
C13C17C16104.7°106.3°
C13C17O2113.4°110.1°
C13C17C20115.7°110.1°
C16C17O2111.3°110.1°
C16C17C20111.8°110.1°
C17C16H22110.1°110.0°
C17C16H23110.2°110.0°
O2C17C20100.2°110.1°
C17O2H6109.5°114.0°
C17C20C22132.1°126.6°
C17C20C21125.1°126.6°
C20C22O23116.3°108.4°
C22C20C21102.8°106.8°
C20C22H31121.8°125.8°
C22O23C24101.4°109.4°
O23C22H31121.8°125.8°
C20C21C24103.4°106.8°
C20C21H30128.3°126.6°
O23C24C21116.1°108.4°
O23C24H32122.0°125.7°
C24C21H30128.3°126.6°
C21C24H32121.9°125.8°
H1C1H2109.5°109.5°
H3C2H4109.5°109.4°
H7C4H8109.5°109.5°
H10C6H11109.5°109.5°
H12C7H13109.5°109.5°
H16C11H17109.4°109.7°
H18C12H19109.5°109.1°
H20C15H21109.5°110.7°
H22C16H23109.5°110.1°
H24C18H25109.4°109.5°
H24C18H26109.4°109.5°
H25C18H26109.5°109.6°
H27C19H28109.4°109.5°
H27C19H29109.4°109.5°
H28C19H29109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O3C3C4C2119.9°120.0°
O3C3C4H5121.7°120.0°
O3C3C2H5120.2°120.0°
O3C3C4C561.1°60.0°
O3C3C2C162.9°60.0°
O3C3C2H3177.1°60.0°
O3C3C2H457.1°180.0°
O3C3C4H759.1°60.0°
O3C3C4H8178.6°180.0°
C4C3C2H5118.5°120.0°
C3C4C5H7120.2°120.0°
C3C4C5H8120.3°120.0°
C3C4C5C6175.6°180.0°
C3C4C5C1057.6°59.9°
C4C3C2C158.5°60.0°
C4C3C2H361.5°179.9°
C4C3C2H4178.5°60.0°
C3C4H7H8119.3°120.0°
C3C4C5H959.6°60.1°
C4C3O3H34180.0°180.0°
C2C3C4C558.8°60.0°
C3C2C1H3120.0°120.0°
C3C2C1H4120.0°120.0°
C3C2C1C1058.7°60.0°
C3C2C1H1179.5°180.0°
C3C2C1H262.1°60.0°
C3C2H3H4119.9°120.0°
C2C3C4H7179.0°180.0°
C2C3C4H861.5°60.0°
C2C3O3H3460.0°60.0°
C4C5C6C10127.8°120.1°
C4C5C6H9115.9°120.0°
C4C5C10H9117.2°120.0°
C4C5C10C151.9°59.9°
C4C5C6C770.7°60.1°
C4C5C10C19164.9°179.9°
C4C5C10C972.3°60.2°
C5C4C3H5177.2°180.0°
C5C4H7H8119.2°120.0°
C4C5C6H10168.9°179.9°
C4C5C6H1149.7°59.9°
C6C5C10H9116.4°119.9°
C6C5C10C1178.3°180.0°
C5C6C7H10120.4°120.0°
C5C6C7H11120.4°120.0°
C6C5C10C1968.7°60.0°
C6C5C10C954.1°59.9°
C5C6C7C856.2°59.9°
C6C5C4H755.3°60.0°
C6C5C4H864.2°60.0°
C5C6H10H11118.8°120.0°
C5C6C7H12176.5°180.0°
C5C6C7H1364.1°60.1°
C5C10C1C253.5°59.9°
C5C10C1C19116.6°120.0°
C5C10C1C9121.2°120.1°
C10C5C6C757.2°60.0°
C5C10C19C9121.6°120.0°
C5C10C9C852.8°59.9°
C5C10C9C11178.4°178.5°
C5C10C1H1174.3°179.9°
C5C10C1H267.4°60.1°
C10C5C4H7177.8°179.9°
C10C5C4H862.7°60.1°
C10C5C6H1063.2°60.0°
C10C5C6H11177.5°180.0°
C5C10C9H1564.2°60.9°
C5C10C19H27180.0°60.1°
C5C10C19H2860.0°60.0°
C5C10C19H2960.0°179.9°
C2C1C10H1120.8°119.9°
C2C1C10H2120.8°120.0°
C2C1C10C19170.1°179.9°
C2C1C10C967.7°60.1°
C2C1H1H2117.5°120.0°
C1C2H3H4119.9°120.0°
C1C2C3H5176.9°180.0°
C1C10C19C9124.1°120.0°
C1C10C9C8172.4°180.0°
C1C10C9C1162.0°61.3°
C10C1H1H2117.4°120.1°
C10C1C2H361.3°180.0°
C10C1C2H4178.7°60.0°
C1C10C5H965.3°60.0°
C1C10C9H1555.4°59.3°
C1C10C19H2765.8°60.0°
C1C10C19H2854.2°180.0°
C1C10C19H29174.2°60.0°
C6C7C8H12120.3°120.0°
C6C7C8H13120.3°120.0°
C6C7C8C953.3°59.9°
C6C7C8C14177.4°176.6°
C7C6C5H9173.4°180.0°
C7C6H10H11118.8°120.0°
C6C7H12H13119.0°119.9°
C6C7C8H1462.0°57.5°
C19C10C9C869.1°60.1°
C19C10C9C1156.5°58.6°
C19C10C1H169.1°60.1°
C19C10C1H249.2°59.9°
C19C10C5H947.7°60.0°
C19C10C9H15173.9°179.2°
C10C19H27H28120.0°120.0°
C10C19H27H29120.0°120.0°
C10C19H28H29120.0°120.0°
C10C9C8C752.8°59.8°
C10C9C8C11128.3°119.2°
C10C9C8H15116.9°121.0°
C10C9C11H15117.2°120.9°
C10C9C8C14179.8°177.4°
C10C9C11C12177.0°177.3°
C9C10C1H153.1°59.8°
C9C10C1H2171.5°179.9°
C9C10C5H9170.5°179.9°
C10C9C8H1462.5°58.2°
C10C9C11H1656.6°57.6°
C10C9C11H1762.7°62.9°
C9C10C19H2758.4°180.0°
C9C10C19H28178.3°60.0°
C9C10C19H2961.6°60.0°
C7C8C9C14127.5°122.8°
C7C8C9H14115.3°118.0°
C7C8C9C11179.0°179.0°
C7C8C14H14115.5°119.1°
C7C8C14C1555.8°56.6°
C7C8C14O1466.1°64.8°
C7C8C14C13176.8°173.9°
C8C7C6H1064.2°60.1°
C8C7C6H11176.6°179.9°
C8C7H12H13119.1°120.0°
C7C8C9H1564.2°61.2°
C8C9C11H15114.7°119.8°
C9C8C14H14117.2°118.7°
C8C9C11C1255.0°63.3°
C9C8C14C1571.5°65.6°
C9C8C14O14166.6°173.0°
C9C8C14C1349.5°51.7°
C9C8C7H12173.6°179.9°
C9C8C7H1367.0°60.1°
C8C9C11H16175.4°177.0°
C8C9C11H1765.3°56.4°
C11C9C8C1451.5°58.2°
C9C11C12H16120.3°119.7°
C9C11C12H17120.3°119.8°
C9C11C12C1358.8°62.4°
C11C9C8H1465.7°61.0°
C9C11H16H17119.1°120.5°
C9C11C12H1861.9°57.9°
C9C11C12H19179.5°177.2°
C8C14C15O14121.8°121.5°
C8C14C15C13126.1°123.2°
C8C14O14C13122.3°124.4°
C8C14C15C16150.7°162.5°
C8C14C13C1247.6°49.0°
C8C14C13C1874.5°76.7°
C8C14C13C17164.4°162.8°
C14C8C7H1257.1°56.6°
C14C8C7H1362.3°63.4°
C14C8C9H1563.3°61.6°
C8C14C15H2089.8°79.0°
C8C14C15H2131.1°44.0°
C8C14O14H33180.0°59.2°
C11C12C13C1453.1°54.2°
C11C12C13H18120.7°120.3°
C11C12C13H19120.7°120.3°
C11C12C13C1871.6°72.0°
C11C12C13C17165.6°165.6°
C12C11C9H1559.7°56.4°
C12C11H16H17119.0°120.4°
C11C12H18H19117.8°119.3°
C15C14O14C13111.3°112.1°
C14C15C16H20119.6°118.5°
C14C15C16H21119.5°118.5°
C15C14C13C1279.7°73.5°
C15C14C13C18158.3°160.8°
C15C14C13C1737.1°40.2°
C14C15C16C172.3°23.0°
C15C14C8H14171.3°175.7°
C14C15H20H21121.2°123.0°
C14C15C16H22117.3°96.2°
C14C15C16H23121.9°142.3°
C15C14O14H3353.7°64.3°
O14C14C15C1687.6°76.0°
O14C14C13C12166.1°170.7°
O14C14C13C1844.1°45.0°
O14C14C13C1777.1°75.5°
O14C14C8H1449.4°54.3°
O14C14C15H2032.0°42.5°
O14C14C15H21152.9°165.5°
C13C14C15C1624.6°39.3°
C14C13C12C18124.8°126.2°
C14C13C12C17112.5°111.4°
C14C13C18C17116.2°115.4°
C14C13C17C1635.8°25.7°
C14C13C17O2157.3°144.9°
C14C13C17C2087.8°93.5°
C13C14C8H1467.7°67.0°
C14C13C12H1867.6°66.1°
C14C13C12H19173.8°174.6°
C13C14C15H20144.2°157.8°
C13C14C15H2195.0°79.2°
C14C13C18H24180.0°69.6°
C14C13C18H2560.0°50.4°
C14C13C18H2660.0°170.5°
C13C14O14H3357.7°176.4°
C15C16C17C1320.8°1.7°
C15C16C17H22119.6°119.3°
C15C16C17H23119.6°119.3°
C15C16C17O2143.6°120.8°
C15C16C17C20105.3°117.6°
C16C15H20H21121.3°122.9°
C15C16H22H23121.3°121.5°
C12C13C18C17121.5°119.4°
C12C13C17C1680.8°90.9°
C12C13C17O240.7°28.3°
C12C13C17C20155.7°149.9°
C13C12C11H16179.1°177.9°
C13C12C11H1761.5°57.4°
C13C12H18H19117.8°119.4°
C12C13C18H2457.7°55.6°
C12C13C18H2562.3°175.6°
C12C13C18H26177.7°64.3°
C18C13C17C16158.2°146.8°
C18C13C17O280.3°94.0°
C18C13C17C2034.6°27.6°
C18C13C12H18167.7°167.7°
C18C13C12H1949.1°48.4°
C13C18H24H25120.0°120.0°
C13C18H24H26120.0°119.9°
C13C18H25H26120.0°120.0°
C13C17C16O2122.9°119.2°
C13C17C16C20126.0°119.2°
C13C17O2C20123.9°121.6°
C13C17C20C2283.9°98.0°
C13C17C20C2197.5°82.3°
C13C17O2H6180.0°180.0°
C17C13C12H1844.9°45.3°
C17C13C12H1973.7°74.0°
C13C17C16H22140.3°121.0°
C13C17C16H2398.8°117.6°
C17C13C18H2463.8°175.1°
C17C13C18H25176.2°65.0°
C17C13C18H2656.2°55.1°
C16C17O2C20118.3°121.6°
C16C17C20C2235.8°145.1°
C16C17C20C21142.8°34.5°
C16C17O2H662.3°63.2°
C17C16C15H20121.9°141.6°
C17C16C15H21117.3°95.5°
C17C16H22H23121.3°121.4°
O2C17C20C22153.8°23.5°
O2C17C20C2124.8°156.1°
O2C17C16H2296.8°119.9°
O2C17C16H2324.1°1.5°
C17C20C22C21178.8°179.7°
C17C20C22O23179.5°179.9°
C17C20C21C24179.5°179.9°
C20C17O2H656.1°58.4°
C20C17C16H2214.3°1.7°
C20C17C16H23135.1°123.1°
C17C20C21H300.5°0.1°
C17C20C22H310.5°0.0°
C20C22O23H31180.0°180.0°
C20C22O23C240.4°0.1°
C22C20C21C240.5°0.3°
C22C20C21H30179.5°179.8°
O23C22C20C210.6°0.2°
C22O23C24C210.0°0.0°
C22O23C24H32180.0°179.9°
C20C21C24O230.3°0.2°
C20C21C24H30180.0°179.9°
C21C20C22H31179.4°179.7°
C20C21C24H32179.7°179.9°
O23C24C21H32180.0°179.9°
O23C24C21H30179.7°179.9°
C24O23C22H31179.5°179.8°
H1C1C2H359.5°60.0°
H1C1C2H460.5°59.9°
H2C1C2H3177.8°60.0°
H2C1C2H457.9°179.9°
H3C2C3H557.0°60.0°
H4C2C3H563.0°60.0°
H5C3C4H762.5°60.0°
H5C3C4H857.0°60.0°
H5C3O3H3459.2°60.0°
H7C4C5H960.6°60.0°
H8C4C5H9179.9°179.9°
H9C5C6H1053.0°59.9°
H9C5C6H1166.2°60.1°
H10C6C7H1256.2°59.9°
H10C6C7H13175.5°179.9°
H11C6C7H1263.1°60.1°
H11C6C7H1356.3°59.9°
H12C7C8H1458.3°62.5°
H13C7C8H14177.8°177.5°
H14C8C9H15179.5°179.2°
H15C9C11H1660.6°63.3°
H15C9C11H17180.0°176.2°
H16C11C12H1858.4°61.8°
H16C11C12H1960.2°57.5°
H17C11C12H18177.8°177.7°
H17C11C12H1959.2°63.0°
H20C15C16H222.3°22.3°
H20C15C16H23118.6°99.2°
H21C15C16H22123.2°145.3°
H21C15C16H232.3°23.8°
H24C18H25H26119.9°120.1°
H27C19H28H29119.9°120.0°
H30C21C24H320.3°0.0°

223790

PDB entries from 2024-08-14

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