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A1BWC

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N17C18sing1.37Å1.33ÅAromatic
N17C16sing1.37Å1.38ÅAromatic
C18C19doub1.34Å1.41ÅAromatic
F33C20sing1.40Å1.40Å
F34C20sing1.40Å1.33Å
C16N15doub1.33Å1.44ÅAromatic
C16C1sing1.41Å1.38ÅAromatic
C19C20sing1.51Å1.56Å
C19C1sing1.46Å1.40ÅAromatic
F12C5sing1.35Å1.36Å
N15C14sing1.32Å1.29ÅAromatic
C30O31sing1.43Å1.38Å
C30C29sing1.53Å1.53Å
C20F35sing1.40Å1.43Å
C1C2doub1.40Å1.41ÅAromatic
O31C32sing1.43Å1.40Å
C14C13doub1.38Å1.45ÅAromatic
C32C28sing1.53Å1.53Å
C2C13sing1.39Å1.44ÅAromatic
C2O3sing1.36Å1.37Å
C5C6doub1.38Å1.40ÅAromatic
C5C4sing1.39Å1.47ÅAromatic
C29N27sing1.47Å1.41Å
O3C4sing1.36Å1.44Å
N27C28sing1.47Å1.38Å
N27C26sing1.47Å1.46Å
C6C7sing1.39Å1.44ÅAromatic
O23C21doub1.22Å1.22Å
C4C10doub1.39Å1.35ÅAromatic
C25C26sing1.53Å1.57Å
C25C24sing1.53Å1.54Å
C21N8sing1.35Å1.46Å
C21N22sing1.35Å1.53Å
C7N8sing1.40Å1.41Å
C7C9doub1.39Å1.39ÅAromatic
C24N22sing1.46Å1.45Å
C10C9sing1.38Å1.46ÅAromatic
C10F11sing1.35Å1.30Å
C6H61sing1.08Å1.08Å
C13H131sing1.08Å1.08Å
C24H242sing1.09Å1.10Å
C24H241sing1.09Å1.10Å
C26H262sing1.09Å1.10Å
C26H261sing1.09Å1.10Å
C28H281sing1.09Å1.10Å
C28H282sing1.09Å1.10Å
C14H141sing1.08Å1.08Å
C18H181sing1.08Å1.08Å
C25H251sing1.09Å1.10Å
C25H252sing1.09Å1.10Å
C29H292sing1.09Å1.10Å
C29H291sing1.09Å1.10Å
C30H301sing1.09Å1.10Å
C30H302sing1.09Å1.10Å
C32H321sing1.09Å1.10Å
C32H322sing1.09Å1.10Å
C9H91sing1.08Å1.08Å
N17H171sing0.97Å1.00Å
N22H221sing0.97Å1.00Å
N8H81sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C18N17C16109.4°110.0°
N17C18C19108.4°109.8°
N17C18H181125.8°125.1°
C18N17H171125.3°125.0°
N17C16N15130.2°133.1°
N17C16C1108.1°107.0°
C16N17H171125.3°125.0°
C18C19C20125.7°126.6°
C18C19C1106.7°106.9°
C19C18H181125.8°125.0°
F33C20F34107.6°109.5°
F33C20C19110.9°109.5°
F33C20F35109.6°109.5°
F34C20C19109.6°109.4°
F34C20F35109.9°109.4°
N15C16C1121.7°119.9°
C16N15C14119.9°121.9°
C16C1C19107.3°106.3°
C16C1C2118.8°119.4°
C20C19C1127.6°126.5°
C19C20F35109.2°109.4°
C19C1C2133.8°134.3°
F12C5C6121.3°120.0°
F12C5C4118.8°119.9°
N15C14C13122.5°121.6°
N15C14H141118.7°119.2°
O31C30C29112.3°109.3°
C30O31C32113.9°113.8°
O31C30H301108.8°109.5°
O31C30H302108.7°109.5°
C30C29N27108.1°109.2°
C30C29H292109.8°109.5°
C30C29H291109.8°109.6°
C29C30H301108.8°109.5°
C29C30H302108.8°109.5°
C1C2C13119.7°117.9°
C1C2O3113.0°121.0°
O31C32C28112.9°109.2°
O31C32H321108.6°109.6°
O31C32H322108.6°109.6°
C14C13C2117.3°119.4°
C14C13H131121.4°120.4°
C13C14H141118.8°119.2°
C32C28N27109.5°109.3°
C32C28H281109.4°109.5°
C32C28H282109.5°109.5°
C28C32H321108.6°109.5°
C28C32H322108.6°109.5°
C13C2O3127.2°121.1°
C2C13H131121.3°120.3°
C2O3C4124.9°118.0°
C6C5C4119.9°120.0°
C5C6C7119.4°120.0°
C5C6H61120.3°120.0°
C5C4O3119.0°120.0°
C5C4C10120.3°120.0°
C29N27C28112.0°110.8°
C29N27C26113.0°111.0°
N27C29H292109.8°109.5°
N27C29H291109.8°109.5°
O3C4C10120.5°120.0°
C28N27C26111.1°111.0°
N27C28H281109.5°109.5°
N27C28H282109.5°109.5°
N27C26C25112.1°109.5°
N27C26H262108.8°109.5°
N27C26H261108.8°109.5°
C6C7N8122.1°120.0°
C6C7C9120.1°120.0°
C7C6H61120.3°120.0°
O23C21N8123.8°120.0°
O23C21N22121.5°120.0°
C4C10C9119.7°120.0°
C4C10F11121.4°120.0°
C26C25C24111.3°109.5°
C25C26H262108.8°109.5°
C25C26H261108.8°109.4°
C26C25H251109.0°109.5°
C26C25H252109.0°109.5°
C25C24N22108.3°109.5°
C25C24H242109.8°109.4°
C25C24H241109.8°109.4°
C24C25H251109.0°109.4°
C24C25H252109.0°109.4°
N8C21N22114.7°120.0°
C21N8C7125.0°120.0°
C21N8H81117.5°120.0°
C21N22C24120.9°120.0°
C21N22H221119.5°120.0°
N8C7C9117.4°120.0°
C7N8H81117.5°120.0°
C7C9C10120.5°120.0°
C7C9H91119.8°120.0°
N22C24H242109.8°109.5°
N22C24H241109.8°109.5°
C24N22H221119.5°120.0°
C9C10F11118.8°120.0°
C10C9H91119.8°119.9°
H242C24H241109.5°109.4°
H262C26H261109.5°109.5°
H281C28H282109.5°109.5°
H251C25H252109.5°109.4°
H292C29H291109.5°109.5°
H301C30H302109.5°109.6°
H321C32H322109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C18N17C16H171180.0°179.9°
N17C18C19H181180.0°180.0°
C18N17C16N15179.8°179.7°
C18N17C16C10.1°0.2°
N17C18C19C20179.9°180.0°
N17C18C19C10.0°0.1°
C16N17C18C190.0°0.2°
N17C16N15C1179.7°179.8°
N17C16C1C190.1°0.1°
N17C16N15C14179.8°179.9°
N17C16C1C2179.5°179.9°
C16N17C18H181180.0°179.9°
C18C19C20F330.3°119.9°
C18C19C20F34118.4°120.0°
C18C19C1C160.1°0.0°
C18C19C20C1179.9°179.9°
C18C19C20F35121.1°0.1°
C18C19C1C2179.4°180.0°
C19C18N17H171179.9°180.0°
F33C20F34C19120.7°120.0°
F33C20F34F35119.3°120.0°
F33C20C19F35120.8°120.0°
F33C20C19C1179.8°59.9°
F34C20C19F35120.5°119.9°
F34C20C19C161.5°60.1°
N15C16C1C19179.8°179.8°
N15C16C1C20.2°0.2°
C16N15C14C130.1°0.0°
C16N15C14H141179.9°180.0°
N15C16N17H1710.2°0.2°
C16C1C19C20180.0°179.9°
C16C1C19C2179.5°180.0°
C1C16N15C140.1°0.2°
C16C1C2C130.8°0.0°
C16C1C2O3179.0°179.9°
C1C16N17H171179.9°180.0°
C20C19C1C20.5°0.1°
C20C19C18H1810.1°0.0°
C1C19C20F3559.0°180.0°
C19C1C2C13179.7°180.0°
C19C1C2O31.6°0.1°
C1C19C18H181180.0°179.9°
F12C5C6C4178.9°179.9°
F12C5C4O33.9°0.3°
F12C5C6C7178.3°180.0°
F12C5C4C10178.4°180.0°
F12C5C6H611.7°0.0°
N15C14C13H141180.0°180.0°
N15C14C13C20.7°0.3°
N15C14C13H131179.3°179.9°
O31C30C29H301120.4°119.9°
O31C30C29H302120.4°120.0°
C30O31C32C2847.6°58.7°
O31C30C29N2755.3°56.8°
O31C30C29H29264.5°63.1°
O31C30C29H291175.1°176.8°
O31C30H301H302118.7°120.2°
C30O31C32H32172.8°178.6°
C30O31C32H322168.2°61.2°
C29C30O31C3249.8°58.7°
C30C29N27H292119.8°119.8°
C30C29N27H291119.8°120.0°
C30C29N27C2861.7°58.5°
C30C29N27C26171.9°177.7°
C30C29H292H291120.6°120.2°
C29C30H301H302118.7°120.1°
C1C2C13C141.0°0.3°
C1C2C13O3177.9°179.9°
C1C2O3C4165.8°180.0°
C1C2C13H131179.0°179.9°
O31C32C28H321120.5°120.0°
O31C32C28H322120.5°120.0°
O31C32C28N2751.5°56.8°
O31C32C28H281171.5°176.8°
O31C32C28H28268.5°63.2°
C32O31C30H301170.2°61.2°
C32O31C30H30270.6°178.6°
O31C32H321H322118.4°120.2°
C14C13C2H131180.0°179.7°
C14C13C2O3178.9°179.7°
C32C28N27C2959.9°58.6°
C32C28N27H281120.0°120.0°
C32C28N27H282120.0°120.0°
C32C28N27C26172.6°177.6°
C32C28H281H282120.0°120.1°
C28C32H321H322118.4°120.0°
C13C2O3C416.2°0.0°
C2C13C14H141179.3°179.8°
C2O3C4C591.0°89.7°
C2O3C4C1094.5°90.0°
O3C2C13H1311.1°0.0°
C6C5C4O3177.2°179.7°
C5C6C7H61180.0°180.0°
C6C5C4C102.6°0.0°
C5C6C7N8176.7°180.0°
C5C6C7C93.6°0.0°
C5C4O3C10174.5°179.7°
C4C5C6C70.6°0.0°
C5C4C10C92.8°0.1°
C5C4C10F11178.9°179.9°
C4C5C6H61179.4°180.0°
C29N27C28C26127.5°123.8°
C29N27C26C2569.5°170.0°
C29N27C26H262170.1°50.0°
C29N27C26H26150.9°70.1°
C29N27C28H281179.9°178.6°
C29N27C28H28260.1°61.4°
N27C29H292H291120.6°120.1°
N27C29C30H301175.7°63.1°
N27C29C30H30265.1°176.8°
O3C4C10C9177.2°179.7°
O3C4C10F114.5°0.2°
C28N27C26C25163.6°66.4°
C28N27C26H26243.2°173.6°
C28N27C26H26176.0°53.6°
N27C28H281H282120.0°120.0°
C28N27C29H29258.0°61.3°
C28N27C29H291178.5°178.6°
N27C28C32H32169.0°176.8°
N27C28C32H322172.0°63.2°
N27C26C25H262120.4°120.0°
N27C26C25H261120.4°120.0°
N27C26C25C24168.0°180.0°
N27C26H262H261118.8°120.0°
C26N27C28H28152.6°57.7°
C26N27C28H28267.4°62.3°
N27C26C25H25147.7°60.0°
N27C26C25H25271.8°60.0°
C26N27C29H29268.4°62.5°
C26N27C29H29152.1°57.6°
C6C7N8C2115.9°33.3°
C6C7N8C9173.3°180.0°
C6C7C9C103.5°0.0°
C6C7C9H91176.5°180.0°
C6C7N8H81164.1°146.7°
O23C21N8N22178.3°179.9°
O23C21N8C75.0°5.3°
O23C21N22C241.1°0.1°
O23C21N22H221178.9°180.0°
O23C21N8H81175.0°174.7°
C4C10C9C70.2°0.1°
C4C10C9F11178.4°180.0°
C4C10C9H91179.7°180.0°
C26C25C24H251120.3°120.0°
C26C25C24H252120.3°120.0°
C26C25C24N2265.8°180.0°
C26C25C24H24254.0°60.0°
C26C25C24H241174.4°60.0°
C25C26H262H261118.8°120.0°
C26C25H251H252119.2°120.0°
C25C24N22C2154.1°180.0°
C25C24N22H242119.8°120.0°
C25C24N22H241119.8°120.0°
C25C24H242H241120.6°119.9°
C24C25C26H26271.6°60.0°
C24C25C26H26147.6°60.0°
C24C25H251H252119.1°119.9°
C25C24N22H221125.9°0.0°
C21N8C7H81180.0°180.0°
C21N8C7C9170.8°146.7°
N8C21N22C24179.5°180.0°
N8C21N22H2210.5°0.1°
N22C21N8C7176.6°174.7°
C21N22C24H221180.0°179.9°
C21N22C24H242173.9°60.0°
C21N22C24H24165.7°60.0°
N22C21N8H813.3°5.4°
N8C7C9C10176.9°180.0°
N8C7C6H613.3°0.0°
N8C7C9H913.1°0.0°
C7C9C10H91180.0°180.0°
C7C9C10F11178.1°179.9°
C9C7C6H61176.4°180.0°
C9C7N8H819.2°33.3°
N22C24H242H241120.5°120.0°
N22C24C25H251173.9°60.0°
N22C24C25H25254.5°59.9°
F11C10C9H911.9°0.0°
H131C13C14H1410.7°0.1°
H242C24C25H25166.3°60.1°
H242C24C25H252174.3°180.0°
H242C24N22H2216.0°120.0°
H241C24C25H25154.1°180.0°
H241C24C25H25265.3°60.1°
H241C24N22H221114.3°120.0°
H262C26C25H251168.1°180.0°
H262C26C25H25248.6°60.0°
H261C26C25H25172.7°60.0°
H261C26C25H252167.8°180.0°
H281C28C32H32151.0°63.3°
H281C28C32H32268.0°56.8°
H282C28C32H321171.0°56.8°
H282C28C32H32252.0°176.8°
H181C18N17H1710.1°0.0°
H292C29C30H30156.0°177.0°
H292C29C30H302175.2°56.9°
H291C29C30H30164.5°56.9°
H291C29C30H30254.7°63.2°

250835

PDB entries from 2026-03-18

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