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EC5

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O26C26doub1.22Å1.25Å
C26N27sing1.35Å1.42Å
C26C25sing1.40Å1.42Å
N27C28sing1.47Å1.50Å
N27C22sing1.36Å1.39Å
C28C29sing1.53Å1.59Å
C28C21sing1.51Å1.48Å
C29C6sing1.51Å1.54Å
C6C5sing1.38Å1.42ÅAromatic
C6C1doub1.38Å1.43ÅAromatic
C5C4doub1.38Å1.41ÅAromatic
C4C3sing1.38Å1.39ÅAromatic
C3C2doub1.38Å1.44ÅAromatic
C2C1sing1.38Å1.42ÅAromatic
C21O23sing1.34Å1.29Å
C21O22doub1.21Å1.26Å
C25C24doub1.38Å1.40Å
C24C23sing1.39Å1.48Å
C24C17sing1.51Å1.54Å
C23C18sing1.51Å1.52Å
C23C22doub1.38Å1.47Å
C18C20sing1.53Å1.51Å
C18C19sing1.53Å1.50Å
C20C19sing1.53Å1.51Å
C22S30sing1.76Å1.68Å
S30O56sing1.66Å1.67Å
C17C16sing1.51Å1.57Å
C16C7sing1.36Å1.41ÅAromatic
C16C15doub1.41Å1.39ÅAromatic
C7C8doub1.39Å1.40ÅAromatic
C8C9sing1.36Å1.39ÅAromatic
C9C10doub1.41Å1.38ÅAromatic
C10C15sing1.42Å1.39ÅAromatic
C10C11sing1.41Å1.42ÅAromatic
C15C14sing1.41Å1.41ÅAromatic
C11C12doub1.36Å1.42ÅAromatic
C12C13sing1.39Å1.40ÅAromatic
C13C14doub1.36Å1.40ÅAromatic
C25H25sing1.08Å1.08Å
C29H291sing1.09Å1.10Å
C29H292sing1.09Å1.10Å
C5HAsing1.08Å1.08Å
C1HBsing1.08Å1.08Å
C4HCsing1.08Å1.08Å
C3HDsing1.08Å1.08Å
C2HEsing1.08Å1.08Å
O23H23sing0.97Å0.95Å
C17H171sing1.09Å1.10Å
C17H172sing1.09Å1.10Å
C18H18sing1.09Å1.10Å
C20H201sing1.09Å1.10Å
C20H202sing1.09Å1.10Å
C19H191sing1.09Å1.10Å
C19H192sing1.09Å1.10Å
O56H56sing0.97Å0.95Å
C7H7sing1.08Å1.08Å
C8H8sing1.08Å1.08Å
C9H9sing1.08Å1.08Å
C11H11sing1.08Å1.08Å
C14H14sing1.08Å1.08Å
C12H12sing1.08Å1.08Å
C13H13sing1.08Å1.08Å
C28H28sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O26C26N27114.7°119.9°
O26C26C25123.6°119.9°
N27C26C25121.7°120.3°
C26N27C28119.7°119.6°
C26N27C22118.2°120.8°
C26C25C24120.9°119.6°
C26C25H25119.5°120.2°
C28N27C22121.9°119.6°
N27C28C29108.9°109.4°
N27C28C21115.4°109.5°
N27C28H28105.2°109.5°
N27C22C23123.7°120.4°
N27C22S30115.2°119.8°
C29C28C21107.9°109.5°
C28C29C6118.1°109.5°
C28C29H291106.7°109.5°
C28C29H292104.7°109.4°
C29C28H28113.1°109.5°
C28C21O23114.8°120.0°
C28C21O22117.8°120.0°
C21C28H28106.4°109.5°
C29C6C5118.9°120.0°
C29C6C1121.2°120.0°
C6C29H291106.7°109.5°
C6C29H292104.7°109.5°
C5C6C1119.9°120.0°
C6C5C4120.7°120.0°
C6C5HA119.6°120.0°
C6C1C2119.5°120.0°
C6C1HB120.2°120.0°
C5C4C3119.6°120.0°
C4C5HA119.7°120.0°
C5C4HC120.2°120.0°
C4C3C2121.7°120.1°
C3C4HC120.2°120.0°
C4C3HD119.1°120.0°
C3C2C1118.6°120.0°
C2C3HD119.1°120.0°
C3C2HE120.7°120.0°
C2C1HB120.3°120.0°
C1C2HE120.7°120.0°
O23C21O22127.3°120.0°
C21O23H23109.5°117.0°
C25C24C23120.1°119.2°
C25C24C17119.3°120.4°
C24C25H25119.6°120.2°
C23C24C17120.5°120.4°
C24C23C18122.1°120.2°
C24C23C22115.2°119.7°
C24C17C16108.5°109.5°
C24C17H171109.8°109.5°
C24C17H172110.0°109.4°
C18C23C22122.1°120.2°
C23C18C20116.9°117.5°
C23C18C19117.2°117.5°
C23C18H1893.5°115.5°
C23C22S30121.1°119.8°
C20C18C1960.2°60.0°
C18C20C1959.7°60.0°
C20C18H18135.1°117.5°
C18C20H201131.1°117.5°
C18C20H202136.2°117.5°
C18C19C2060.2°60.0°
C19C18H18134.8°117.5°
C18C19H191130.8°117.5°
C18C19H192135.9°117.5°
C19C20H201131.1°117.5°
C19C20H202136.2°117.5°
C20C19H191130.8°117.4°
C20C19H192135.9°117.5°
C22S30O5695.4°100.0°
S30O56H56109.5°114.0°
C17C16C7121.5°120.2°
C17C16C15121.2°120.1°
C16C17H171109.8°109.5°
C16C17H172110.0°109.4°
C7C16C15117.2°119.7°
C16C7C8121.3°121.0°
C16C7H7119.4°119.5°
C16C15C10121.8°119.3°
C16C15C14119.4°121.3°
C7C8C9119.4°121.0°
C8C7H7119.4°119.6°
C7C8H8120.3°119.5°
C8C9C10119.8°119.7°
C9C8H8120.3°119.5°
C8C9H9120.1°120.2°
C9C10C15120.5°119.3°
C9C10C11118.6°121.3°
C10C9H9120.1°120.1°
C15C10C11120.9°119.4°
C10C15C14118.9°119.3°
C10C11C12119.6°119.6°
C10C11H11120.2°120.2°
C15C14C13121.1°119.7°
C15C14H14119.4°120.2°
C11C12C13119.5°121.0°
C12C11H11120.2°120.1°
C11C12H12120.3°119.5°
C12C13C14119.8°121.0°
C13C12H12120.2°119.4°
C12C13H13120.1°119.5°
C13C14H14119.5°120.2°
C14C13H13120.1°119.5°
H291C29H292116.5°109.5°
H171C17H172108.7°109.5°
H201C20H20274.5°115.6°
H191C19H19274.9°115.6°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O26C26N27C25178.4°179.7°
O26C26N27C284.6°0.0°
O26C26N27C22179.5°180.0°
O26C26C25C24178.5°180.0°
O26C26C25H251.5°0.1°
C26N27C28C22174.7°179.9°
C26N27C28C29142.6°60.0°
C26N27C28C2195.9°60.0°
N27C26C25C240.3°0.3°
C26N27C22C231.6°0.0°
C26N27C22S30179.7°180.0°
N27C26C25H25179.7°179.8°
C26N27C28H2821.0°180.0°
C25C26N27C28173.7°179.7°
C25C26N27C221.1°0.3°
C26C25C24H25180.0°179.9°
C26C25C24C233.1°0.1°
C26C25C24C17178.4°180.0°
N27C28C29C21126.0°120.0°
N27C28C29H28116.7°120.0°
N27C28C21H28116.3°120.0°
N27C28C29C687.1°65.0°
N27C28C21O23158.6°180.0°
N27C28C21O2220.2°0.0°
C28N27C22C23176.3°180.0°
C28N27C22S305.6°0.0°
N27C28C29H29132.9°55.0°
N27C28C29H292157.0°175.0°
C22N27C28C2932.1°120.0°
C22N27C28C2189.4°120.0°
N27C22C23C244.7°0.2°
N27C22C23C18176.0°179.9°
N27C22C23S30178.0°180.0°
N27C22S30O5686.3°67.4°
C22N27C28H28153.7°0.1°
C29C28C21H28121.7°120.0°
C28C29C6H291120.0°120.1°
C28C29C6H292115.9°120.0°
C28C29C6C5143.9°90.1°
C28C29C6C135.4°90.3°
C29C28C21O2336.6°60.0°
C29C28C21O22142.2°120.0°
C28C29H291H292116.5°120.0°
C21C28C29C6146.9°175.0°
C28C21O23O22178.7°180.0°
C21C28C29H29193.1°65.0°
C21C28C29H29231.0°55.0°
C28C21O23H23178.7°180.0°
C29C6C5C1179.3°179.7°
C29C6C5C4178.4°180.0°
C29C6C1C2179.3°179.8°
C6C29H291H292116.4°120.0°
C29C6C5HA1.6°0.0°
C29C6C1HB0.7°0.0°
C6C29C28H2829.6°54.9°
C6C5C4HA180.0°180.0°
C6C5C4C31.4°0.0°
C5C6C1C20.0°0.5°
C5C6C29H29196.1°30.0°
C5C6C29H29228.0°150.0°
C5C6C1HB180.0°179.7°
C6C5C4HC178.6°180.0°
C1C6C5C40.9°0.3°
C6C1C2C30.4°0.5°
C6C1C2HB180.0°179.8°
C1C6C29H29184.6°149.7°
C1C6C29H292151.3°29.7°
C1C6C5HA179.1°179.7°
C6C1C2HE179.6°179.7°
C5C4C3HC180.0°180.0°
C5C4C3C21.0°0.0°
C5C4C3HD179.0°179.9°
C4C3C2HD180.0°180.0°
C4C3C2C10.1°0.2°
C3C4C5HA178.6°180.0°
C4C3C2HE179.9°180.0°
C3C2C1HE180.0°179.8°
C3C2C1HB179.6°179.8°
C2C3C4HC179.0°180.0°
C1C2C3HD179.9°179.8°
O23C21C28H2885.1°60.0°
O22C21O23H230.0°0.0°
O22C21C28H2896.1°120.0°
C25C24C23C17178.5°179.9°
C25C24C23C18176.7°180.0°
C25C24C23C225.4°0.2°
C25C24C17C1697.8°95.3°
C25C24C17H17122.2°24.8°
C25C24C17H172141.8°144.8°
C24C23C18C22170.7°179.8°
C24C23C18C20138.1°125.4°
C24C23C18C1969.6°56.8°
C24C23C22S30177.3°179.7°
C23C24C17C1683.7°84.6°
C23C24C25H25176.9°180.0°
C23C24C17H171156.3°155.3°
C23C24C17H17236.7°35.4°
C24C23C18H1876.1°88.9°
C17C24C23C184.8°0.1°
C17C24C23C22176.2°179.7°
C24C17C16H171120.0°120.1°
C24C17C16H172120.4°119.9°
C24C17C16C715.2°93.4°
C24C17C16C15168.7°86.3°
C17C24C25H251.6°0.1°
C24C17H171H172120.4°120.0°
C23C18C20C19107.5°107.5°
C23C18C20H18127.3°145.0°
C23C18C19H18127.5°145.0°
C18C23C22S306.0°0.1°
C23C18C20H20112.5°0.0°
C23C18C20H202125.8°145.0°
C23C18C19H191133.1°145.0°
C23C18C19H19219.8°0.0°
C22C23C18C2051.2°54.7°
C22C23C18C19119.7°123.4°
C23C22S30O5691.9°112.6°
C22C23C18H1894.6°91.0°
C20C18C19H18125.6°107.5°
C18C20C19H201120.0°107.5°
C18C20C19H202126.7°107.5°
C18C20H201H202138.7°145.7°
C20C18C19H191120.0°107.4°
C20C18C19H192126.7°107.5°
C18C19H191H192138.6°145.7°
C19C20H201H202138.7°145.7°
C20C19H191H192138.5°145.7°
C22S30O56H56122.9°180.0°
C17C16C7C15176.2°179.7°
C17C16C7C8178.7°180.0°
C17C16C15C10177.8°179.8°
C17C16C15C140.1°0.1°
C16C17H171H172120.4°120.0°
C17C16C7H71.3°0.0°
C16C7C8H7180.0°180.0°
C16C7C8C91.4°0.0°
C7C16C15C101.6°0.5°
C7C16C15C14176.3°179.7°
C7C16C17H171104.8°146.5°
C7C16C17H172135.6°26.5°
C16C7C8H8178.6°179.9°
C15C16C7C82.5°0.3°
C16C15C10C90.3°0.4°
C16C15C10C14177.9°179.9°
C16C15C10C11179.2°179.8°
C16C15C14C13177.4°179.3°
C15C16C17H17171.3°33.7°
C15C16C17H17248.3°153.7°
C15C16C7H7177.5°179.8°
C16C15C14H142.6°0.1°
C7C8C9H8180.0°179.9°
C7C8C9C100.5°0.1°
C7C8C9H9179.5°179.9°
C8C9C10H9180.0°180.0°
C8C9C10C151.4°0.2°
C8C9C10C11179.7°179.9°
C9C8C7H7178.6°180.0°
C9C10C15C11178.9°179.8°
C9C10C15C14178.2°179.7°
C9C10C11C12179.8°180.0°
C10C9C8H8179.5°180.0°
C9C10C11H110.2°0.0°
C15C10C11C120.9°0.2°
C10C15C14C134.6°0.6°
C15C10C9H9178.6°179.8°
C15C10C11H11179.1°179.8°
C10C15C14H14175.4°179.8°
C11C10C15C142.9°0.1°
C10C11C12H11180.0°180.0°
C10C11C12C130.5°0.1°
C11C10C9H90.3°0.1°
C10C11C12H12179.5°180.0°
C15C14C13C124.3°0.9°
C15C14C13H14180.0°179.1°
C15C14C13H13175.7°179.7°
C11C12C13H12180.0°179.9°
C11C12C13C142.1°0.6°
C11C12C13H13177.8°180.0°
C12C13C14H13180.0°179.4°
C13C12C11H11179.5°180.0°
C12C13C14H14175.7°180.0°
C14C13C12H12177.9°179.5°
H291C29C28H28149.5°175.0°
H292C29C28H2886.4°65.0°
HAC5C4HC1.4°0.0°
HBC1C2HE0.4°0.1°
HCC4C3HD1.0°0.0°
HDC3C2HE0.1°0.0°
H18C18C20H201114.8°145.0°
H18C18C20H2021.5°0.0°
H18C18C19H1915.6°0.1°
H18C18C19H192107.7°145.0°
H201C20C19H191120.0°145.0°
H201C20C19H1926.7°0.0°
H202C20C19H1916.7°0.0°
H202C20C19H192106.6°145.0°
H7C7C8H81.4°0.1°
H8C8C9H90.5°0.0°
H11C11C12H120.5°0.0°
H14C14C13H134.3°0.6°
H12C12C13H132.2°0.0°

222415

PDB entries from 2024-07-10

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