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00J

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O30C26doub1.22Å1.21Å
C26N28sing1.35Å1.33Å
C26C25sing1.47Å1.49Å
N28C2sing1.46Å1.46Å
C25C21sing1.48Å1.40ÅAromatic
C25C17doub1.36Å1.48ÅAromatic
C21C6sing1.39Å1.39ÅAromatic
C21C24doub1.40Å1.39ÅAromatic
C6C4doub1.38Å1.39ÅAromatic
C24O31sing1.35Å1.42ÅAromatic
C24C10sing1.39Å1.38ÅAromatic
O31C17sing1.34Å1.36ÅAromatic
C17C1sing1.51Å1.50Å
C10C19doub1.38Å1.40ÅAromatic
C19C4sing1.39Å1.40ÅAromatic
C19O34sing1.36Å1.37Å
O34C22sing1.36Å1.38Å
C22C7doub1.38Å1.40ÅAromatic
C22C20sing1.41Å1.39ÅAromatic
C7C8sing1.39Å1.39ÅAromatic
C20C5sing1.40Å1.39ÅAromatic
C20C23doub1.42Å1.40ÅAromatic
C5C3doub1.36Å1.39ÅAromatic
C23N27sing1.34Å1.36ÅAromatic
C23C9sing1.40Å1.39ÅAromatic
N27C8doub1.31Å1.34ÅAromatic
C9C18doub1.38Å1.40ÅAromatic
C18C3sing1.40Å1.39ÅAromatic
C18O33sing1.36Å1.37Å
O33C16sing1.43Å1.43Å
C16C15sing1.53Å1.53Å
C15N29sing1.47Å1.47Å
N29C11sing1.47Å1.48Å
N29C12sing1.47Å1.48Å
C11C13sing1.53Å1.53Å
C12C14sing1.53Å1.53Å
C14O32sing1.43Å1.43Å
O32C13sing1.43Å1.43Å
N28H28sing0.97Å1.00Å
C2H21Csing1.09Å1.10Å
C2H22Csing1.09Å1.10Å
C2H23Csing1.09Å1.10Å
C6H6sing1.08Å1.08Å
C4H4sing1.08Å1.08Å
C10H10sing1.08Å1.08Å
C1H11Csing1.09Å1.10Å
C1H12Csing1.09Å1.10Å
C1H13Csing1.09Å1.10Å
C7H7sing1.08Å1.08Å
C8H8sing1.08Å1.08Å
C5H5sing1.08Å1.08Å
C3H3sing1.08Å1.08Å
C9H9sing1.08Å1.08Å
C16H161sing1.09Å1.10Å
C16H162sing1.09Å1.10Å
C15H151sing1.09Å1.10Å
C15H152sing1.09Å1.10Å
C11H111sing1.09Å1.10Å
C11H112sing1.09Å1.10Å
C12H121sing1.09Å1.10Å
C12H122sing1.09Å1.10Å
C13H131sing1.09Å1.10Å
C13H132sing1.09Å1.10Å
C14H141sing1.09Å1.10Å
C14H142sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O30C26N28120.1°120.0°
O30C26C25119.3°120.0°
N28C26C25120.6°120.0°
C26N28C2125.7°120.1°
C26N28H28117.1°119.9°
C26C25C21122.4°127.2°
C26C25C17128.4°127.1°
C2N28H28117.2°120.0°
N28C2H21C109.5°109.5°
N28C2H22C109.5°109.5°
N28C2H23C109.5°109.5°
C21C25C17109.2°105.7°
C25C21C6134.4°134.1°
C25C21C24104.3°105.4°
C25C17O31106.8°109.8°
C25C17C1135.6°125.1°
C6C21C24121.3°120.4°
C21C6C4118.0°119.7°
C21C6H6121.0°120.2°
C21C24O31113.1°107.7°
C21C24C10121.3°119.3°
C6C4C19120.4°120.2°
C4C6H6121.0°120.2°
C6C4H4119.8°119.9°
O31C24C10125.5°133.0°
C24O31C17106.5°111.4°
C24C10C19117.7°119.9°
C24C10H10121.1°120.1°
O31C17C1117.5°125.1°
C17C1H11C109.5°109.4°
C17C1H12C109.5°109.5°
C17C1H13C109.5°109.5°
C10C19C4121.2°120.5°
C10C19O34119.6°119.7°
C19C10H10121.2°120.0°
C4C19O34119.2°119.8°
C19C4H4119.8°119.9°
C19O34C22119.6°118.0°
O34C22C7121.8°121.0°
O34C22C20119.6°121.0°
C7C22C20118.6°118.0°
C22C7C8120.1°119.7°
C22C7H7120.0°120.1°
C22C20C5119.9°121.2°
C22C20C23119.3°118.9°
C7C8N27120.3°121.8°
C8C7H7120.0°120.2°
C7C8H8119.8°119.1°
C5C20C23120.8°119.9°
C20C5C3119.4°119.8°
C20C5H5120.3°120.1°
C20C23N27120.6°120.0°
C20C23C9119.5°119.1°
C5C3C18120.3°120.8°
C3C5H5120.3°120.1°
C5C3H3119.9°119.6°
N27C23C9119.8°120.9°
C23N27C8121.0°121.6°
C23C9C18119.8°119.6°
C23C9H9120.1°120.2°
N27C8H8119.8°119.1°
C9C18C3120.3°120.8°
C9C18O33121.0°119.7°
C18C9H9120.1°120.2°
C3C18O33118.8°119.6°
C18C3H3119.8°119.6°
C18O33C16121.3°117.1°
O33C16C15109.7°109.5°
O33C16H161109.4°109.5°
O33C16H162109.3°109.5°
C16C15N29111.2°109.5°
C15C16H161109.4°109.5°
C15C16H162109.3°109.4°
C16C15H151108.9°109.5°
C16C15H152108.5°109.5°
C15N29C11110.0°111.0°
C15N29C12108.5°111.0°
N29C15H151108.9°109.5°
N29C15H152108.5°109.5°
C11N29C12110.8°110.7°
N29C11C13109.8°109.3°
N29C11H111109.4°109.5°
N29C11H112109.3°109.5°
N29C12C14110.1°109.2°
N29C12H121109.2°109.5°
N29C12H122109.1°109.5°
C11C13O32109.1°109.2°
C13C11H111109.4°109.6°
C13C11H112109.3°109.5°
C11C13H131109.6°109.5°
C11C13H132109.6°109.5°
C12C14O32109.6°109.3°
C14C12H121109.3°109.5°
C14C12H122109.1°109.5°
C12C14H141109.4°109.5°
C12C14H142109.4°109.5°
C14O32C13113.1°113.7°
O32C14H141109.4°109.6°
O32C14H142109.4°109.5°
O32C13H131109.6°109.5°
O32C13H132109.7°109.5°
H21CC2H22C109.4°109.5°
H21CC2H23C109.5°109.4°
H22CC2H23C109.5°109.5°
H11CC1H12C109.5°109.5°
H11CC1H13C109.5°109.4°
H12CC1H13C109.5°109.5°
H161C16H162109.7°109.5°
H151C15H152110.9°109.5°
H111C11H112109.7°109.5°
H121C12H122110.0°109.5°
H131C13H132109.2°109.6°
H141C14H142109.6°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O30C26N28C25179.3°179.8°
O30C26N28C20.5°0.0°
O30C26C25C211.4°90.0°
O30C26C25C17177.8°90.3°
O30C26N28H28179.5°180.0°
C26N28C2H28180.0°180.0°
N28C26C25C21179.3°90.2°
N28C26C25C171.5°89.4°
C26N28C2H21C13.6°60.0°
C26N28C2H22C106.3°180.0°
C26N28C2H23C133.7°60.0°
C25C26N28C2179.9°179.7°
C26C25C21C17179.4°179.7°
C26C25C21C60.6°0.1°
C26C25C21C24179.5°180.0°
C26C25C17O31179.3°179.9°
C26C25C17C10.7°0.0°
C25C26N28H280.2°0.2°
N28C2H21CH22C120.0°120.1°
N28C2H21CH23C120.0°120.0°
N28C2H22CH23C120.0°120.0°
C25C21C6C24179.9°179.9°
C25C21C6C4179.8°180.0°
C25C21C24O310.2°0.0°
C25C21C24C10179.9°180.0°
C21C25C17O310.0°0.4°
C21C25C17C1179.9°179.7°
C25C21C6H60.2°0.0°
C17C25C21C6180.0°179.8°
C17C25C21C240.1°0.2°
C25C17O31C240.1°0.4°
C25C17O31C1180.0°179.9°
C25C17C1H11C12.3°89.9°
C25C17C1H12C132.3°150.0°
C25C17C1H13C107.7°29.9°
C21C6C4H6180.0°180.0°
C6C21C24O31179.9°180.0°
C6C21C24C100.2°0.0°
C21C6C4C190.1°0.0°
C21C6C4H4179.9°180.0°
C24C21C6C40.1°0.0°
C21C24O31C10179.7°180.0°
C21C24O31C170.2°0.2°
C21C24C10C190.4°0.0°
C24C21C6H6179.9°179.9°
C21C24C10H10179.6°180.0°
C6C4C19C100.2°0.0°
C6C4C19H4180.0°179.9°
C6C4C19O34179.2°180.0°
C24O31C17C1179.8°179.7°
O31C24C10C19179.9°180.0°
O31C24C10H100.0°0.0°
C10C24O31C17179.9°179.8°
C24C10C19H10180.0°180.0°
C24C10C19C40.4°0.0°
C24C10C19O34179.5°180.0°
O31C17C1H11C167.7°90.0°
O31C17C1H12C47.7°30.1°
O31C17C1H13C72.3°150.2°
C17C1H11CH12C120.0°120.1°
C17C1H11CH13C120.0°119.9°
C17C1H12CH13C120.0°120.0°
C10C19C4O34179.0°180.0°
C10C19O34C2284.8°112.2°
C10C19C4H4179.8°180.0°
C4C19O34C2294.2°67.8°
C19C4C6H6179.9°179.9°
C4C19C10H10179.6°180.0°
C19O34C22C711.5°6.2°
C19O34C22C20168.2°174.1°
O34C19C4H40.8°0.0°
O34C19C10H100.6°0.1°
O34C22C7C20179.7°179.8°
O34C22C7C8179.9°180.0°
O34C22C20C50.1°0.0°
O34C22C20C23179.7°180.0°
O34C22C7H70.2°0.0°
C22C7C8H7180.0°180.0°
C7C22C20C5179.6°179.8°
C7C22C20C230.6°0.2°
C22C7C8N270.0°0.0°
C22C7C8H8180.0°180.0°
C20C22C7C80.4°0.2°
C22C20C5C23179.8°180.0°
C22C20C5C3179.9°179.9°
C22C20C23N270.4°0.0°
C22C20C23C9179.9°180.0°
C20C22C7H7179.6°179.8°
C22C20C5H50.1°0.0°
C7C8N27C230.2°0.3°
C7C8N27H8180.0°180.0°
C20C5C3H5180.0°180.0°
C5C20C23N27179.8°180.0°
C5C20C23C90.3°0.1°
C20C5C3C180.0°0.1°
C20C5C3H3180.0°180.0°
C23C20C5C30.1°0.0°
C20C23N27C9179.5°180.0°
C20C23N27C80.0°0.2°
C20C23C9C180.4°0.0°
C23C20C5H5179.9°180.0°
C20C23C9H9179.6°180.0°
C5C3C18C90.1°0.1°
C5C3C18H3180.0°179.9°
C5C3C18O33179.9°180.0°
N27C23C9C18179.9°180.0°
C23N27C8H8179.8°179.7°
N27C23C9H90.1°0.1°
C9C23N27C8179.5°179.7°
C23C9C18H9180.0°179.9°
C23C9C18C30.3°0.0°
C23C9C18O33179.7°180.0°
N27C8C7H7179.9°180.0°
C9C18C3O33180.0°179.9°
C9C18O33C1611.9°180.0°
C9C18C3H3179.9°180.0°
C3C18O33C16168.1°0.1°
C18C3C5H5180.0°179.9°
C3C18C9H9179.7°179.9°
C18O33C16C15156.7°180.0°
O33C18C3H30.1°0.1°
O33C18C9H90.3°0.0°
C18O33C16H16136.7°59.9°
C18O33C16H16283.4°60.1°
O33C16C15H161120.0°120.1°
O33C16C15H162119.9°120.0°
O33C16C15N2959.4°65.0°
O33C16H161H162119.9°120.0°
O33C16C15H15160.6°175.0°
O33C16C15H152178.7°54.9°
C16C15N29H151120.0°120.0°
C16C15N29H152119.3°120.0°
C16C15N29C1179.8°170.0°
C16C15N29C12158.8°66.3°
C15C16H161H162119.9°119.9°
C16C15H151H152119.3°120.0°
C15N29C11C12120.0°123.8°
C15N29C11C13176.9°177.6°
C15N29C12C14176.9°177.6°
N29C15C16H161179.4°55.0°
N29C15C16H16260.5°175.0°
N29C15H151H152119.3°120.0°
C15N29C11H11156.9°62.4°
C15N29C11H11263.2°57.6°
C15N29C12H12163.0°57.7°
C15N29C12H12257.2°62.4°
N29C11C13H111120.0°120.0°
N29C11C13H112119.9°119.9°
C11N29C12C1456.1°58.6°
N29C11C13O3257.4°56.9°
C11N29C15H151160.2°70.0°
C11N29C15H15239.5°50.0°
N29C11H111H112119.8°120.1°
C11N29C12H121176.1°178.5°
C11N29C12H12263.6°61.4°
N29C11C13H131177.4°176.8°
N29C11C13H13262.7°63.1°
C12N29C11C1356.9°58.6°
N29C12C14H121120.0°119.9°
N29C12C14H122119.7°119.9°
N29C12C14O3255.9°56.9°
C12N29C15H15138.8°53.7°
C12N29C15H15281.9°173.7°
C12N29C11H11163.1°61.4°
C12N29C11H112176.8°178.6°
N29C12H121H122119.7°120.1°
N29C12C14H14164.1°63.2°
N29C12C14H142175.8°176.8°
C11C13O32C1460.0°58.7°
C11C13O32H131120.0°119.9°
C11C13O32H132120.1°120.0°
C13C11H111H112119.9°120.1°
C11C13H131H132120.1°120.1°
C12C14O32H141120.0°120.0°
C12C14O32H142120.0°119.9°
C12C14O32C1359.3°58.7°
C14C12H121H122119.7°120.1°
C12C14H141H142120.0°120.0°
O32C14C12H121175.9°176.8°
O32C14C12H12263.9°63.0°
C14O32C13H131180.0°178.6°
C14O32C13H13260.1°61.3°
O32C14H141H142119.9°120.1°
O32C13C11H11162.6°63.1°
O32C13C11H112177.3°176.8°
O32C13H131H132120.2°120.1°
C13O32C14H14160.7°61.3°
C13O32C14H142179.2°178.6°
H28N28C2H21C166.4°120.0°
H28N28C2H22C73.7°0.1°
H28N28C2H23C46.3°120.1°
H21CC2H22CH23C120.0°119.9°
H6C6C4H40.1°0.0°
H11CC1H12CH13C120.0°119.9°
H7C7C8H80.1°0.0°
H5C5C3H30.0°0.0°
H161C16C15H15159.4°65.0°
H161C16C15H15261.3°175.0°
H162C16C15H151179.5°55.0°
H162C16C15H15258.8°65.0°
H111C11C13H13157.4°56.8°
H111C11C13H132177.3°176.9°
H112C11C13H13162.7°63.3°
H112C11C13H13257.2°56.8°
H121C12C14H14155.9°56.8°
H121C12C14H14264.2°63.3°
H122C12C14H141176.1°176.9°
H122C12C14H14256.1°56.9°

218500

PDB entries from 2024-04-17

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