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A1IA3

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C27O26sing1.43Å1.41Å
C27C28sing1.50Å1.54Å
O26C23sing1.43Å1.42Å
O30C28doub1.21Å1.21Å
C23C24sing1.52Å1.54Å
C23C22sing1.53Å1.59Å
C28N29sing1.36Å1.34Å
C24C25sing1.54Å1.55Å
N29C22sing1.47Å1.46Å
C22C21sing1.53Å1.55Å
C25N20sing1.47Å1.49Å
C4C3sing1.53Å1.54Å
C4C5sing1.53Å1.52Å
C21N20sing1.47Å1.47Å
N20C1sing1.35Å1.41Å
C3N2sing1.47Å1.53Å
C6C5sing1.53Å1.54Å
C6C7sing1.51Å1.49Å
C5C17sing1.53Å1.55Å
N2C1sing1.35Å1.39Å
N2C18sing1.47Å1.46Å
C1O19doub1.22Å1.26Å
C7C16doub1.38Å1.41ÅAromatic
C7C8sing1.38Å1.42ÅAromatic
C16C15sing1.38Å1.39ÅAromatic
C17C18sing1.53Å1.53Å
C8C9doub1.38Å1.38ÅAromatic
C15C10doub1.38Å1.40ÅAromatic
C9C10sing1.38Å1.38ÅAromatic
C10C11sing1.51Å1.50Å
F14C11sing1.40Å1.35Å
C11F12sing1.40Å1.35Å
C11F13sing1.40Å1.34Å
C8H1sing1.08Å1.08Å
C9H2sing1.08Å1.08Å
C5H3sing1.09Å1.10Å
C6H4sing1.09Å1.10Å
C6H5sing1.09Å1.10Å
C4H6sing1.09Å1.10Å
C4H7sing1.09Å1.10Å
C3H8sing1.09Å1.10Å
C3H9sing1.09Å1.10Å
C15H10sing1.08Å1.08Å
C16H11sing1.08Å1.08Å
C17H12sing1.09Å1.10Å
C17H13sing1.09Å1.10Å
C18H14sing1.09Å1.10Å
C18H15sing1.09Å1.10Å
C21H16sing1.09Å1.10Å
C21H17sing1.09Å1.10Å
C22H18sing1.09Å1.10Å
C23H19sing1.09Å1.10Å
C24H20sing1.09Å1.10Å
C24H21sing1.09Å1.10Å
C25H22sing1.09Å1.10Å
C25H23sing1.09Å1.10Å
C27H24sing1.09Å1.10Å
C27H25sing1.09Å1.10Å
N29H26sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O26C27C28113.2°110.2°
C27O26C23113.9°112.6°
O26C27H24108.5°109.4°
O26C27H25108.5°109.4°
C27C28O30120.0°118.6°
C27C28N29118.7°123.3°
C28C27H24108.5°109.4°
C28C27H25108.5°109.3°
O26C23C24109.7°111.1°
O26C23C22107.6°109.7°
O26C23H19110.0°107.9°
O30C28N29120.9°118.1°
C24C23C22113.3°111.3°
C23C24C25111.3°109.6°
C24C23H19108.4°108.7°
C23C24H20109.0°109.4°
C23C24H21109.0°109.3°
C23C22N29106.6°109.2°
C23C22C21109.0°109.8°
C23C22H18108.1°109.9°
C22C23H19107.8°107.9°
C28N29C22124.7°120.9°
C28N29H26117.7°119.0°
C24C25N20110.7°107.6°
C25C24H20109.0°110.4°
C25C24H21109.0°108.9°
C24C25H22109.2°109.7°
C24C25H23109.2°109.7°
N29C22C21114.8°108.2°
N29C22H18109.7°109.9°
C22N29H26117.6°120.1°
C22C21N20107.5°109.4°
C22C21H16110.0°109.5°
C22C21H17110.0°109.5°
C21C22H18108.5°109.9°
C25N20C21112.6°118.4°
C25N20C1120.6°120.8°
N20C25H22109.2°111.1°
N20C25H23109.2°109.0°
C3C4C5108.8°109.4°
C4C3N2106.7°108.7°
C3C4H6109.7°109.5°
C3C4H7109.6°109.5°
C4C3H8110.2°109.6°
C4C3H9110.2°109.6°
C4C5C6106.5°109.3°
C4C5C17110.8°109.4°
C4C5H3110.0°109.7°
C5C4H6109.6°109.5°
C5C4H7109.6°109.5°
C21N20C1120.7°120.8°
N20C21H16109.9°109.5°
N20C21H17110.0°109.5°
N20C1N2117.0°120.0°
N20C1O19121.2°120.0°
C3N2C1119.9°120.6°
C3N2C18113.5°118.8°
N2C3H8110.2°109.6°
N2C3H9110.1°109.6°
C5C6C7113.5°109.5°
C6C5C17110.3°109.5°
C6C5H3109.7°109.4°
C5C6H4108.4°109.4°
C5C6H5108.4°109.5°
C6C7C16118.4°120.0°
C6C7C8122.2°120.0°
C7C6H4108.5°109.5°
C7C6H5108.5°109.5°
C5C17C18112.4°109.4°
C17C5H3109.5°109.5°
C5C17H12108.7°109.5°
C5C17H13108.7°109.5°
C1N2C18118.0°120.6°
N2C1O19121.8°120.0°
N2C18C17108.7°108.7°
N2C18H14109.7°109.6°
N2C18H15109.6°109.6°
C16C7C8119.4°120.0°
C7C16C15119.2°120.0°
C7C16H11120.4°120.0°
C7C8C9120.7°120.0°
C7C8H1119.6°120.0°
C16C15C10119.9°120.0°
C16C15H10120.1°120.0°
C15C16H11120.3°120.0°
C18C17H12108.7°109.3°
C18C17H13108.7°109.7°
C17C18H14109.6°109.6°
C17C18H15109.7°109.6°
C8C9C10119.0°120.0°
C9C8H1119.6°120.0°
C8C9H2120.5°120.0°
C15C10C9121.7°120.0°
C15C10C11118.4°120.0°
C10C15H10120.1°120.0°
C9C10C11119.8°120.0°
C10C9H2120.5°120.0°
C10C11F14112.2°109.5°
C10C11F12113.6°109.4°
C10C11F13113.6°109.4°
F14C11F12105.9°109.5°
F14C11F13104.7°109.5°
F12C11F13106.0°109.4°
H4C6H5109.5°109.5°
H6C4H7109.5°109.6°
H8C3H9109.5°109.8°
H12C17H13109.5°109.5°
H14C18H15109.5°109.7°
H16C21H17109.4°109.5°
H20C24H21109.4°109.3°
H22C25H23109.5°109.7°
H24C27H25109.5°109.2°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O26C27C28H24120.6°120.2°
O26C27C28H25120.5°120.2°
O26C27C28O30176.6°166.0°
C27O26C23C24167.7°168.0°
C27O26C23C2268.6°68.5°
O26C27C28N293.5°15.1°
C27O26C23H1948.6°48.9°
O26C27H24H25118.3°119.7°
C28C27O26C2338.2°47.1°
C27C28O30N29173.0°179.0°
C27C28N29C2212.2°4.1°
C28C27H24H25118.3°119.6°
C27C28N29H26167.9°177.1°
O26C23C24C22120.2°122.6°
O26C23C24H19120.2°118.6°
O26C23C22H19118.6°117.4°
O26C23C24C2573.2°62.8°
O26C23C22N2955.1°52.5°
O26C23C22C2169.4°65.9°
O26C23C22H18172.9°173.1°
O26C23C24H20166.5°176.0°
O26C23C24H2147.1°56.4°
C23O26C27H24158.7°167.3°
C23O26C27H2582.4°73.1°
O30C28N29C22174.8°177.0°
O30C28C27H2456.0°45.8°
O30C28C27H2562.9°73.8°
O30C28N29H265.2°1.8°
C24C23C22H19119.9°119.2°
C23C24C25H20120.3°120.5°
C23C24C25H21120.3°119.5°
C24C23C22N29176.5°175.9°
C24C23C22C2152.1°57.5°
C23C24C25N2049.9°55.7°
C24C23C22H1865.6°63.5°
C23C24H20H21119.2°119.7°
C23C24C25H22170.1°65.4°
C23C24C25H2370.3°174.1°
C23C22N29C2816.7°21.9°
C22C23C24C2547.0°59.8°
C23C22N29C21120.8°119.4°
C23C22N29H18116.7°120.6°
C23C22C21H18117.4°121.0°
C23C22C21N2059.5°51.9°
C23C22C21H1660.2°171.9°
C23C22C21H17179.2°68.0°
C22C23C24H2073.3°61.4°
C22C23C24H21167.3°179.0°
C23C22N29H26163.3°159.3°
C28N29C22H26180.0°178.8°
C28N29C22C21104.0°97.5°
C28N29C22H18133.5°142.5°
N29C28C27H24117.1°135.3°
N29C28C27H25124.0°105.1°
C24C25N20H22120.2°120.1°
C24C25N20H23120.2°118.9°
C24C25N20C2161.8°56.4°
C24C25N20C1145.5°124.0°
C25C24C23H19166.6°178.5°
C25C24H20H21119.1°119.7°
C24C25H22H23119.4°120.6°
N29C22C21H18123.1°120.0°
N29C22C21N20179.0°170.9°
N29C22C21H1659.3°69.1°
N29C22C21H1761.3°51.0°
N29C22C23H1963.6°64.9°
C22C21N20C2566.7°54.9°
C22C21N20H16119.7°120.0°
C22C21N20H17119.7°120.0°
C22C21N20C1140.6°125.4°
C22C21H16H17120.9°120.1°
C21C22C23H19172.0°176.7°
C21C22N29H2676.0°81.3°
C25N20C21C1152.7°179.6°
C25N20C1N247.9°23.1°
C25N20C1O19132.1°156.9°
C25N20C21H1653.0°174.9°
C25N20C21H17173.6°65.1°
N20C25C24H2070.4°64.9°
N20C25C24H21170.2°175.2°
N20C25H22H23119.5°120.6°
C3C4C5H6119.9°120.0°
C3C4C5H7119.9°119.9°
C4C3N2H8119.6°119.7°
C4C3N2H9119.6°119.8°
C3C4C5C6178.0°178.5°
C3C4C5C1757.9°61.6°
C4C3N2C1148.4°126.4°
C4C3N2C1864.4°53.4°
C3C4C5H363.3°58.5°
C3C4H6H7120.3°120.1°
C4C3H8H9121.3°120.4°
C5C4C3N261.4°54.6°
C4C5C6C17120.4°119.8°
C4C5C6H3119.0°120.2°
C4C5C6C7176.9°65.2°
C4C5C17H3121.5°120.2°
C4C5C17C1853.3°61.6°
C4C5C6H456.3°174.8°
C4C5C6H562.5°54.8°
C5C4H6H7120.3°120.0°
C5C4C3H8179.0°65.1°
C5C4C3H958.1°174.4°
C4C5C17H12173.8°178.7°
C4C5C17H1367.1°58.7°
C21N20C1N2161.5°156.6°
C21N20C1O1918.5°23.5°
N20C21H16H17120.9°120.0°
N20C21C22H1857.9°69.0°
C21N20C25H22178.0°63.7°
C21N20C25H2358.4°175.2°
N20C1N2C340.4°11.0°
N20C1N2O19180.0°179.9°
N20C1N2C18173.8°169.2°
C1N20C21H1699.7°5.4°
C1N20C21H1720.9°114.6°
C1N20C25H2225.3°115.9°
C1N20C25H2394.4°5.1°
C3N2C1C18145.8°179.8°
C3N2C1O19139.6°169.1°
C3N2C18C1758.9°53.4°
N2C3C4H6178.6°65.3°
N2C3C4H758.4°174.6°
N2C3H8H9121.3°120.4°
C3N2C18H14178.8°173.2°
C3N2C18H1561.0°66.4°
C5C6C7H4120.6°120.0°
C5C6C7H5120.6°120.0°
C6C5C17H3120.8°120.0°
C5C6C7C16146.4°90.0°
C5C6C7C833.4°90.3°
C6C5C17C18171.1°178.6°
C5C6H4H5118.1°120.0°
C6C5C4H662.1°61.5°
C6C5C4H758.1°58.6°
C6C5C17H1268.5°58.9°
C6C5C17H1350.6°61.1°
C7C6C5C1762.7°175.0°
C6C7C16C8179.8°179.7°
C6C7C16C15179.6°179.8°
C6C7C8C9178.2°179.7°
C6C7C8H11.8°0.3°
C7C6C5H357.9°55.0°
C7C6H4H5118.2°120.0°
C6C7C16H110.4°0.3°
C5C17C18N252.0°54.8°
C5C17C18H12120.5°119.8°
C5C17C18H13120.4°120.2°
C17C5C6H4176.6°55.0°
C17C5C6H557.9°65.0°
C17C5C4H6177.9°58.4°
C17C5C4H761.9°178.5°
C5C17H12H13118.6°120.1°
C5C17C18H14171.9°174.5°
C5C17C18H1567.9°65.1°
C1N2C18C17153.2°126.4°
C1N2C3H828.8°113.9°
C1N2C3H992.0°6.6°
C1N2C18H1433.4°6.6°
C1N2C18H1586.9°113.8°
C18N2C1O196.2°10.7°
N2C18C17H14119.9°119.7°
N2C18C17H15119.9°119.8°
C18N2C3H8176.0°66.3°
C18N2C3H955.2°173.2°
N2C18C17H12172.4°174.6°
N2C18C17H1368.5°65.4°
N2C18H14H15120.4°120.4°
C7C16C15H11180.0°179.9°
C16C7C8C91.6°0.0°
C7C16C15C102.8°0.1°
C16C7C8H1178.4°180.0°
C16C7C6H493.0°150.0°
C16C7C6H525.8°30.0°
C7C16C15H10177.2°179.9°
C8C7C16C150.6°0.1°
C7C8C9H1180.0°180.0°
C7C8C9C101.5°0.0°
C7C8C9H2178.4°180.0°
C8C7C6H487.2°29.7°
C8C7C6H5154.0°149.7°
C8C7C16H11179.4°180.0°
C16C15C10H10180.0°180.0°
C16C15C10C92.9°0.1°
C16C15C10C11177.9°179.9°
C18C17C5H368.2°58.6°
C18C17H12H13118.6°120.2°
C17C18H14H15120.3°120.4°
C8C9C10C150.7°0.0°
C8C9C10H2180.0°180.0°
C8C9C10C11175.6°180.0°
C15C10C9C11174.9°180.0°
C15C10C11F1488.5°150.0°
C15C10C11F1231.7°90.0°
C15C10C11F13153.0°29.9°
C15C10C9H2179.3°180.0°
C10C15C16H11177.2°180.0°
C9C10C11F1486.6°30.0°
C9C10C11F12153.3°90.1°
C9C10C11F1332.0°150.0°
C10C9C8H1178.5°180.0°
C9C10C15H10177.0°180.0°
C10C11F14F12124.5°120.0°
C10C11F14F13123.6°120.0°
C10C11F12F13125.4°119.9°
C11C10C9H24.4°0.1°
C11C10C15H102.1°0.1°
F14C11F12F13110.9°120.0°
H1C8C9H21.5°0.0°
H3C5C6H462.7°65.0°
H3C5C6H5178.5°175.0°
H3C5C4H656.6°178.5°
H3C5C4H7176.8°61.4°
H3C5C17H1252.3°61.1°
H3C5C17H13171.4°178.9°
H6C4C3H859.1°174.9°
H6C4C3H961.8°54.5°
H7C4C3H861.1°54.8°
H7C4C3H9178.0°65.7°
H10C15C16H112.9°0.0°
H12C17C18H1467.7°65.7°
H12C17C18H1552.6°54.8°
H13C17C18H1451.5°54.4°
H13C17C18H15171.7°174.8°
H16C21C22H18177.6°51.0°
H17C21C22H1861.8°171.0°
H18C22C23H1954.3°55.7°
H18C22N29H2646.5°38.7°
H19C23C24H2046.3°57.4°
H19C23C24H2173.1°62.2°
H20C24C25H2249.8°174.1°
H20C24C25H23169.4°53.5°
H21C24C25H2269.6°54.2°
H21C24C25H2350.0°66.4°

248942

PDB entries from 2026-02-11

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