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VS9

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C18C13sing1.53Å1.52Å
C13C17sing1.52Å1.56Å
C13C12sing1.51Å1.52Å
C13C14sing1.55Å1.55Å
C17C16sing1.55Å1.52Å
C12C11sing1.54Å1.52Å
C16C15sing1.55Å1.53Å
C11C9sing1.52Å1.54Å
C15C14sing1.53Å1.52Å
C14C8sing1.52Å1.52Å
C8C9sing1.52Å1.53Å
C8C7sing1.53Å1.51Å
C9C10sing1.50Å1.51Å
C10C5doub1.38Å1.42ÅAromatic
C10C1sing1.39Å1.39ÅAromatic
C6C5sing1.49Å1.49Å
C6C7sing1.53Å1.53Å
C5C4sing1.39Å1.41ÅAromatic
C1C2doub1.38Å1.37ÅAromatic
C4C3doub1.38Å1.42ÅAromatic
C2C3sing1.39Å1.36ÅAromatic
C3O3sing1.36Å1.42Å
O3S22sing1.52Å1.69Å
N19S22sing1.66Å1.48Å
O20S22doub1.42Å1.40Å
S22O21doub1.42Å1.42Å
C17H1sing1.09Å1.10Å
C17H2sing1.09Å1.10Å
C1H3sing1.08Å1.08Å
C4H4sing1.08Å1.08Å
C12H5sing1.09Å1.10Å
C12H6sing1.09Å1.10Å
C18H7sing1.09Å1.10Å
C18H8sing1.09Å1.10Å
C18H9sing1.09Å1.10Å
C2H10sing1.08Å1.08Å
C16H11sing1.09Å1.10Å
C16H12sing1.09Å1.10Å
C11H13sing1.09Å1.10Å
C11H14sing1.09Å1.10Å
C8H15sing1.09Å1.10Å
C7H16sing1.09Å1.10Å
C7H17sing1.09Å1.10Å
C14H18sing1.09Å1.10Å
C9H19sing1.09Å1.10Å
C6H20sing1.09Å1.10Å
C6H21sing1.09Å1.10Å
C15H22sing1.09Å1.10Å
C15H23sing1.09Å1.10Å
N19H24sing0.97Å1.00Å
N19H25sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C18C13C17110.9°109.6°
C18C13C12109.0°109.6°
C18C13C14113.5°109.6°
C13C18H7109.5°109.5°
C13C18H8109.5°109.5°
C13C18H9109.5°109.5°
C17C13C12114.6°116.8°
C17C13C1498.9°103.3°
C13C17C16104.5°105.3°
C13C17H1110.7°110.3°
C13C17H2110.7°110.4°
C12C13C14109.7°107.6°
C13C12C11111.0°107.7°
C13C12H5109.1°109.8°
C13C12H6109.1°109.8°
C13C14C15104.3°101.6°
C13C14C8112.7°106.4°
C13C14H18105.4°111.5°
C17C16C15108.2°106.4°
C16C17H1110.7°110.2°
C16C17H2110.7°110.3°
C17C16H11109.8°110.1°
C17C16H12109.8°110.1°
C12C11C9112.7°110.6°
C11C12H5109.1°109.8°
C11C12H6109.1°109.8°
C12C11H13108.6°109.3°
C12C11H14108.7°109.2°
C16C15C14102.4°103.0°
C15C16H11109.8°110.0°
C15C16H12109.8°110.1°
C16C15H22111.2°110.7°
C16C15H23111.2°110.7°
C11C9C8109.6°111.2°
C11C9C10114.4°112.0°
C9C11H13108.7°109.2°
C9C11H14108.7°109.3°
C11C9H19107.6°107.9°
C15C14C8121.7°116.1°
C15C14H18105.7°110.5°
C14C15H22111.2°110.8°
C14C15H23111.2°110.8°
C14C8C9105.1°106.6°
C14C8C7113.2°111.3°
C14C8H15109.9°111.2°
C8C14H18105.7°110.4°
C9C8C7108.7°107.9°
C8C9C10109.4°110.0°
C9C8H15109.8°110.0°
C8C9H19107.7°108.4°
C8C7C6109.0°108.3°
C7C8H15110.1°109.8°
C8C7H16109.6°109.7°
C8C7H17109.6°109.7°
C9C10C5124.4°121.8°
C9C10C1117.5°118.3°
C10C9H19107.8°107.2°
C5C10C1118.1°119.9°
C10C5C6119.3°123.0°
C10C5C4120.6°119.5°
C10C1C2121.6°120.7°
C10C1H3119.2°119.6°
C5C6C7112.0°111.3°
C6C5C4120.1°117.5°
C5C6H20108.8°109.1°
C5C6H21108.8°109.1°
C6C7H16109.6°109.7°
C6C7H17109.6°109.7°
C7C6H20108.8°109.4°
C7C6H21108.8°108.7°
C5C4C3118.2°120.6°
C5C4H4120.9°119.7°
C1C2C3121.0°119.7°
C2C1H3119.2°119.7°
C1C2H10119.5°120.1°
C4C3C2120.5°119.6°
C4C3O3124.7°120.2°
C3C4H4120.9°119.6°
C2C3O3114.8°120.2°
C3C2H10119.5°120.2°
C3O3S22120.1°114.0°
O3S22N1996.5°107.2°
O3S22O20105.0°106.4°
O3S22O21105.5°106.4°
N19S22O20116.0°106.4°
N19S22O21112.4°106.4°
S22N19H24109.5°120.0°
S22N19H25109.5°120.0°
O20S22O21118.1°123.2°
H1C17H2109.4°110.3°
H5C12H6109.4°109.9°
H7C18H8109.5°109.4°
H7C18H9109.5°109.5°
H8C18H9109.5°109.4°
H11C16H12109.5°110.1°
H13C11H14109.5°109.2°
H16C7H17109.4°109.7°
H20C6H21109.5°109.1°
H22C15H23109.5°110.8°
H24N19H25109.5°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C18C13C17C12124.0°125.4°
C18C13C17C14119.4°116.7°
C18C13C12C14124.8°119.1°
C18C13C17C1682.3°87.4°
C18C13C12C1174.2°55.8°
C18C13C14C1570.7°72.3°
C18C13C14C863.3°49.6°
C18C13C17H1158.5°31.5°
C18C13C17H236.9°153.6°
C18C13C12H546.0°175.4°
C18C13C12H6165.5°63.7°
C13C18H7H8120.0°120.0°
C13C18H7H9120.0°120.1°
C13C18H8H9120.0°120.1°
C18C13C14H18178.2°170.0°
C17C13C12C14110.2°115.5°
C13C17C16H1119.2°118.9°
C13C17C16H2119.2°119.1°
C17C13C12C11160.8°178.8°
C13C17C16C1515.4°3.5°
C17C13C14C1546.8°44.5°
C17C13C14C8179.1°166.4°
C13C17H1H2122.3°122.1°
C17C13C12H579.0°59.2°
C17C13C12H640.5°61.7°
C17C13C18H7180.0°61.5°
C17C13C18H860.0°178.6°
C17C13C18H960.0°58.6°
C13C17C16H11135.2°122.7°
C13C17C16H12104.4°115.8°
C17C13C14H1864.3°73.2°
C12C13C17C16153.7°147.2°
C13C12C11H5120.3°119.5°
C13C12C11H6120.3°119.5°
C13C12C11C952.8°57.0°
C12C13C14C15167.0°168.6°
C12C13C14C858.9°69.5°
C12C13C17H134.5°93.9°
C12C13C17H287.0°28.2°
C13C12H5H6119.3°120.9°
C12C13C18H752.9°68.0°
C12C13C18H8172.9°52.0°
C12C13C18H967.1°172.0°
C13C12C11H1367.7°63.3°
C13C12C11H14173.3°177.3°
C12C13C14H1855.9°51.0°
C14C13C17C1637.2°29.3°
C14C13C12C1150.6°63.2°
C13C14C15C1637.9°41.6°
C13C14C15C8128.8°114.9°
C13C14C15H18110.9°118.4°
C13C14C8H18114.6°121.1°
C13C14C8C963.7°66.2°
C13C14C8C7177.8°176.3°
C14C13C17H182.1°148.2°
C14C13C17H2156.4°89.7°
C14C13C12H5170.9°56.3°
C14C13C12H669.6°177.2°
C14C13C18H769.7°174.2°
C14C13C18H850.3°65.9°
C14C13C18H9170.3°54.1°
C13C14C8H1554.4°53.6°
C13C14C15H22156.8°160.0°
C13C14C15H2381.0°76.7°
C17C16C15H11119.8°119.2°
C17C16C15H12119.8°119.3°
C17C16C15C1413.5°24.0°
C16C17H1H2122.3°122.0°
C17C16H11H12120.6°121.6°
C17C16C15H22132.4°142.4°
C17C16C15H23105.4°94.4°
C12C11C9H13120.5°120.3°
C12C11C9H14120.5°120.3°
C12C11C9C859.5°56.6°
C12C11C9C10177.2°179.9°
C11C12H5H6119.3°120.9°
C12C11H13H14118.5°119.4°
C12C11C9H1957.4°62.2°
C16C15C14H22118.9°118.4°
C16C15C14H23118.9°118.3°
C16C15C14C8166.7°156.6°
C15C16C17H1103.8°122.4°
C15C16C17H2134.6°115.6°
C15C16H11H12120.6°121.5°
C16C15C14H1873.0°76.7°
C16C15H22H23123.3°123.1°
C11C9C8C1462.2°61.1°
C11C9C8C10126.2°124.6°
C11C9C8H19116.8°118.5°
C11C9C8C7176.4°179.3°
C11C9C10H19119.7°118.2°
C11C9C10C5138.2°145.4°
C11C9C10C141.7°34.8°
C9C11C12H5173.0°62.5°
C9C11C12H667.5°176.5°
C9C11H13H14118.5°119.5°
C11C9C8H1556.0°59.5°
C15C14C8H18120.3°126.7°
C15C14C8C9171.2°178.4°
C15C14C8C752.8°64.2°
C14C15C16H11106.3°95.2°
C14C15C16H12133.3°143.3°
C15C14C8H1570.7°58.6°
C14C15H22H23123.3°123.3°
C14C8C9C7121.4°119.6°
C14C8C9H15118.1°120.6°
C14C8C7H15123.4°123.5°
C14C8C9C10171.6°174.3°
C14C8C7C6172.7°173.2°
C14C8C7H1667.3°67.1°
C14C8C7H1752.8°53.5°
C14C8C9H1954.6°57.4°
C8C14C15H2274.4°85.1°
C8C14C15H2347.8°38.2°
C9C8C7H15120.3°119.9°
C8C9C10H19116.9°117.7°
C8C9C10C514.8°21.2°
C8C9C10C1165.1°159.0°
C9C8C7C670.9°70.1°
C8C9C11H1360.9°63.7°
C8C9C11H14180.0°176.9°
C9C8C7H1649.0°49.6°
C9C8C7H17169.1°170.1°
C9C8C14H1850.9°54.8°
C7C8C9C1050.2°54.7°
C8C7C6C551.7°48.3°
C8C7C6H16120.0°119.7°
C8C7C6H17119.9°119.7°
C8C7H16H17120.2°120.6°
C7C8C14H1867.5°62.6°
C7C8C9H1966.8°62.2°
C8C7C6H2068.6°168.9°
C8C7C6H21172.1°72.0°
C9C10C5C1179.9°179.8°
C9C10C5C62.7°0.8°
C9C10C5C4179.2°179.3°
C9C10C1C2179.5°179.5°
C9C10C1H30.6°0.5°
C10C9C11H1362.4°59.8°
C10C9C11H1456.7°59.6°
C10C9C8H1570.2°65.1°
C10C5C6C4176.5°179.9°
C10C5C6C715.6°14.8°
C5C10C1C20.5°0.3°
C10C5C4C31.8°0.3°
C5C10C1H3179.5°179.7°
C10C5C4H4178.2°179.8°
C5C10C9H19102.1°96.5°
C10C5C6H20104.8°135.6°
C10C5C6H21136.0°105.3°
C1C10C5C6177.4°179.4°
C1C10C5C40.9°0.5°
C10C1C2H3180.0°180.0°
C10C1C2C30.8°0.1°
C10C1C2H10179.2°179.8°
C1C10C9H1978.0°83.3°
C5C6C7H20120.4°120.7°
C5C6C7H21120.4°120.3°
C6C5C4C3178.3°179.5°
C6C5C4H41.7°0.3°
C5C6C7H1668.2°71.4°
C5C6C7H17171.7°168.0°
C5C6H20H21118.8°119.2°
C7C6C5C4160.9°165.4°
C6C7C8H1549.3°49.7°
C6C7H16H17120.2°120.6°
C7C6H20H21118.8°118.8°
C5C4C3H4180.0°179.9°
C5C4C3C21.5°0.0°
C5C4C3O3177.8°179.9°
C4C5C6H2078.7°44.6°
C4C5C6H2140.5°74.6°
C1C2C3C40.2°0.2°
C1C2C3H10180.0°179.9°
C1C2C3O3179.2°179.6°
C4C3C2O3179.4°179.9°
C4C3O3S2268.0°90.1°
C4C3C2H10179.8°179.7°
C2C3O3S22112.5°90.0°
C3C2C1H3179.2°179.9°
C2C3C4H4178.5°179.9°
C3O3S22N19162.6°75.0°
C3O3S22O2078.2°38.6°
C3O3S22O2147.2°171.5°
O3C3C4H42.1°0.3°
O3C3C2H100.8°0.4°
O3S22N19O20110.2°113.5°
O3S22N19O21109.7°113.5°
O3S22O20O21117.2°122.9°
O3S22N19H24180.0°0.0°
O3S22N19H2560.0°180.0°
N19S22O20O21137.7°123.0°
S22N19H24H25120.0°179.9°
O20S22N19H2469.8°113.5°
O20S22N19H2550.2°66.4°
O21S22N19H2470.3°113.5°
O21S22N19H25169.7°66.5°
H1C17C16H1116.0°118.4°
H1C17C16H12136.4°3.2°
H2C17C16H11105.6°3.6°
H2C17C16H1214.8°125.2°
H3C1C2H100.8°0.2°
H5C12C11H1352.6°177.2°
H5C12C11H1466.5°57.8°
H6C12C11H13172.1°56.2°
H6C12C11H1453.0°63.2°
H7C18H8H9120.0°119.9°
H11C16C15H2212.6°23.2°
H11C16C15H23134.9°146.4°
H12C16C15H22107.8°98.3°
H12C16C15H2314.4°24.9°
H13C11C9H19177.8°177.5°
H14C11C9H1963.1°58.1°
H15C8C7H16169.3°169.4°
H15C8C7H1770.6°70.0°
H15C8C14H18169.0°174.7°
H15C8C9H19172.8°178.0°
H16C7C6H20171.4°49.2°
H16C7C6H2152.2°168.3°
H17C7C6H2051.3°71.4°
H17C7C6H2167.9°47.7°
H18C14C15H2245.9°41.6°
H18C14C15H23168.1°164.9°

220472

PDB entries from 2024-05-29

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