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VMC

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O26C22sing1.36Å1.37Å
C21C22doub1.39Å1.40ÅAromatic
C21C20sing1.38Å1.39ÅAromatic
C22C23sing1.39Å1.42ÅAromatic
C20C19doub1.40Å1.39ÅAromatic
C28O27sing1.43Å1.44Å
C23O27sing1.36Å1.39Å
C23C24doub1.38Å1.40ÅAromatic
C19C24sing1.40Å1.40ÅAromatic
C19C9sing1.48Å1.49Å
C7C6sing1.53Å1.53Å
C7N8sing1.47Å1.48Å
C6C3sing1.53Å1.53Å
C9N8sing1.37Å1.34ÅAromatic
C9C10doub1.38Å1.49ÅAromatic
N8C12sing1.36Å1.35ÅAromatic
C25N2sing1.47Å1.48Å
C18C17doub1.38Å1.40ÅAromatic
C18C13sing1.39Å1.40ÅAromatic
C3N2sing1.47Å1.48Å
C3C4sing1.54Å1.53Å
N2C1sing1.48Å1.48Å
C12N11doub1.30Å1.35ÅAromatic
C10C13sing1.48Å1.49Å
C10N11sing1.35Å1.35ÅAromatic
C17C16sing1.38Å1.40ÅAromatic
C13C14doub1.40Å1.40ÅAromatic
C4C5sing1.55Å1.52Å
C1C5sing1.55Å1.52Å
C16C15doub1.38Å1.40ÅAromatic
C14C15sing1.38Å1.40ÅAromatic
O26H1sing0.97Å0.95Å
C21H2sing1.08Å1.08Å
C20H3sing1.08Å1.08Å
C28H4sing1.09Å1.10Å
C28H5sing1.09Å1.10Å
C28H6sing1.09Å1.10Å
C24H7sing1.08Å1.08Å
C18H8sing1.08Å1.08Å
C17H9sing1.08Å1.08Å
C16H10sing1.08Å1.08Å
C15H11sing1.08Å1.08Å
C14H12sing1.08Å1.08Å
C12H13sing1.08Å1.08Å
C7H14sing1.09Å1.10Å
C7H15sing1.09Å1.10Å
C6H16sing1.09Å1.10Å
C6H17sing1.09Å1.10Å
C3H18sing1.09Å1.10Å
C25H20sing1.09Å1.10Å
C25H21sing1.09Å1.10Å
C25H22sing1.09Å1.10Å
C4H23sing1.09Å1.10Å
C4H24sing1.09Å1.10Å
C5H25sing1.09Å1.10Å
C5H26sing1.09Å1.10Å
C1H27sing1.09Å1.10Å
C1H28sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O26C22C21116.5°119.9°
O26C22C23123.6°119.9°
C22O26H1109.5°114.0°
C22C21C20120.8°120.1°
C21C22C23119.9°120.2°
C22C21H2119.6°119.9°
C21C20C19119.8°120.0°
C20C21H2119.6°120.0°
C21C20H3120.1°120.0°
C22C23O27126.1°120.0°
C22C23C24118.4°120.0°
C20C19C24120.1°119.8°
C20C19C9119.5°120.0°
C19C20H3120.1°120.0°
C28O27C23129.4°117.0°
O27C28H4109.5°109.5°
O27C28H5109.5°109.4°
O27C28H6109.4°109.4°
O27C23C24115.5°120.0°
C23C24C19121.1°119.8°
C23C24H7119.5°120.1°
C24C19C9120.4°120.1°
C19C24H7119.5°120.1°
C19C9N8123.3°126.9°
C19C9C10130.5°126.8°
C6C7N8115.8°109.5°
C7C6C3116.1°109.5°
C6C7H14107.9°109.4°
C6C7H15107.8°109.5°
C7C6H16107.8°109.4°
C7C6H17107.8°109.5°
C7N8C9125.9°126.4°
C7N8C12125.4°126.3°
N8C7H14107.9°109.5°
N8C7H15107.9°109.4°
C6C3N2111.2°109.9°
C6C3C4112.3°109.9°
C3C6H16107.8°109.5°
C3C6H17107.8°109.5°
C6C3H18109.2°109.9°
N8C9C10106.1°106.2°
C9N8C12108.7°107.3°
C9C10C13130.5°126.3°
C9C10N11105.7°107.4°
N8C12N11111.0°109.4°
N8C12H13124.6°125.3°
C25N2C3114.8°111.0°
C25N2C1113.2°111.0°
N2C25H20109.5°109.5°
N2C25H21109.4°109.5°
N2C25H22109.5°109.5°
C17C18C13119.9°119.9°
C18C17C16120.4°120.2°
C17C18H8120.1°120.0°
C18C17H9119.8°119.9°
C18C13C10121.2°120.2°
C18C13C14119.6°119.7°
C13C18H8120.0°120.1°
N2C3C4105.1°107.2°
C3N2C1106.2°108.6°
N2C3H18109.8°109.9°
C3C4C5106.3°103.0°
C4C3H18109.2°110.0°
C3C4H23110.3°110.7°
C3C4H24110.3°110.7°
N2C1C5105.9°104.8°
N2C1H27110.4°110.4°
N2C1H28110.3°110.4°
C12N11C10108.5°109.6°
N11C12H13124.5°125.3°
C13C10N11123.8°126.3°
C10C13C14119.1°120.1°
C17C16C15119.7°120.3°
C16C17H9119.8°119.9°
C17C16H10120.2°119.9°
C13C14C15120.3°119.9°
C13C14H12119.8°120.0°
C4C5C1106.0°101.7°
C5C4H23110.3°110.7°
C5C4H24110.3°110.8°
C4C5H25110.3°111.0°
C4C5H26110.3°111.0°
C1C5H25110.3°111.0°
C1C5H26110.3°111.0°
C5C1H27110.4°110.4°
C5C1H28110.4°110.4°
C16C15C14120.1°120.1°
C15C16H10120.2°119.8°
C16C15H11120.0°119.9°
C14C15H11120.0°119.9°
C15C14H12119.9°120.1°
H4C28H5109.5°109.5°
H4C28H6109.4°109.5°
H5C28H6109.5°109.5°
H14C7H15109.5°109.5°
H16C6H17109.5°109.5°
H20C25H21109.5°109.4°
H20C25H22109.5°109.5°
H21C25H22109.5°109.5°
H23C4H24109.4°110.8°
H25C5H26109.4°110.9°
H27C1H28109.5°110.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O26C22C21C23179.1°179.7°
O26C22C21C20179.7°180.0°
O26C22C23O270.9°0.0°
O26C22C23C24179.8°180.0°
O26C22C21H20.3°0.0°
C22C21C20H2180.0°180.0°
C22C21C20C190.9°0.0°
C21C22C23O27179.9°179.7°
C21C22C23C240.8°0.3°
C21C22O26H1180.0°89.7°
C22C21C20H3179.1°180.0°
C20C21C22C230.6°0.3°
C21C20C19H3180.0°180.0°
C21C20C19C241.3°0.2°
C21C20C19C9178.8°180.0°
C22C23O27C2820.9°180.0°
C22C23O27C24179.3°180.0°
C22C23C24C191.2°0.1°
C23C22O26H11.0°90.0°
C23C22C21H2179.4°179.7°
C22C23C24H7178.8°180.0°
C20C19C24C231.5°0.2°
C20C19C24C9177.5°179.8°
C20C19C9N886.9°56.6°
C20C19C9C1093.7°123.8°
C19C20C21H2179.1°180.0°
C20C19C24H7178.5°179.7°
C28O27C23C24159.8°0.0°
O27C28H4H5120.0°120.0°
O27C28H4H6120.0°120.0°
O27C28H5H6120.0°119.9°
O27C23C24C19179.4°180.0°
C23O27C28H4180.0°180.0°
C23O27C28H560.0°60.0°
C23O27C28H660.0°60.0°
O27C23C24H70.6°0.0°
C23C24C19H7180.0°180.0°
C23C24C19C9179.0°180.0°
C24C19C9N890.6°123.6°
C24C19C9C1088.8°56.0°
C24C19C20H3178.7°179.8°
C19C9N8C70.9°0.1°
C19C9N8C10179.6°179.7°
C19C9N8C12179.9°179.8°
C19C9C10C130.5°0.0°
C19C9C10N11179.8°180.0°
C9C19C20H31.2°0.0°
C9C19C24H71.0°0.1°
C6C7N8H14120.9°120.0°
C6C7N8H15120.9°120.0°
C7C6C3H16120.9°120.0°
C7C6C3H17121.0°120.0°
C6C7N8C972.3°92.5°
C6C7N8C12108.9°87.2°
C7C6C3N2174.3°66.4°
C7C6C3C456.8°175.8°
C6C7H14H15117.1°120.0°
C7C6H16H17117.0°120.0°
C7C6C3H1864.5°54.6°
N8C7C6C337.7°175.6°
C7N8C9C12179.0°179.7°
C7N8C9C10179.5°179.8°
C7N8C12N11179.7°179.7°
C7N8C12H130.3°0.1°
N8C7H14H15117.1°120.0°
N8C7C6H1683.2°55.6°
N8C7C6H17158.7°64.4°
C6C3N2C2580.1°119.3°
C6C3N2C4121.7°119.4°
C6C3N2H18120.9°121.0°
C6C3C4H18121.3°121.1°
C6C3N2C1153.9°118.4°
C6C3C4C5141.6°141.7°
C3C6C7H1483.2°64.4°
C3C6C7H15158.6°55.6°
C3C6H16H17117.0°120.0°
C6C3C4H2322.1°23.4°
C6C3C4H2498.9°99.9°
C9N8C12N110.7°0.5°
N8C9C10C13180.0°179.7°
N8C9C10N110.3°0.3°
C9N8C12H13179.3°179.9°
C9N8C7H14166.7°147.5°
C9N8C7H1548.5°27.5°
C10C9N8C120.6°0.5°
C9C10C13C1843.7°34.7°
C9C10N11C120.1°0.0°
C9C10C13N11179.6°180.0°
C9C10C13C14138.1°145.0°
N8C12N11H13180.0°179.6°
N8C12N11C100.5°0.3°
C12N8C7H1412.1°32.8°
C12N8C7H15130.2°152.8°
C25N2C3C1125.9°122.3°
C25N2C3C4158.1°121.3°
C25N2C1C5158.1°98.2°
C25N2C3H1840.8°1.7°
N2C25H20H21120.0°120.0°
N2C25H20H22120.0°120.0°
N2C25H21H22120.0°120.1°
C25N2C1H2738.7°20.7°
C25N2C1H2882.4°143.0°
C17C18C13H8180.0°180.0°
C17C18C13C10179.0°180.0°
C18C17C16H9180.0°180.0°
C17C18C13C140.9°0.3°
C18C17C16C150.2°0.1°
C18C17C16H10179.8°179.9°
C18C13C10C14178.1°179.7°
C18C13C10N11135.9°145.3°
C13C18C17C160.4°0.1°
C18C13C14C150.8°0.6°
C13C18C17H9179.6°180.0°
C18C13C14H12179.2°179.7°
N2C3C4H18117.7°119.5°
N2C3C4C520.6°22.2°
C3N2C1C531.3°24.1°
N2C3C6H1664.8°53.5°
N2C3C6H1753.3°173.5°
C3N2C25H20180.0°60.0°
C3N2C25H2160.0°180.0°
C3N2C25H2260.0°60.0°
N2C3C4H2398.9°96.1°
N2C3C4H24140.1°140.7°
C3N2C1H2788.2°142.9°
C3N2C1H28150.7°94.8°
C4C3N2C132.2°1.0°
C3C4C5H23119.5°118.3°
C3C4C5H24119.5°118.4°
C3C4C5C11.8°35.6°
C4C3C6H16177.7°64.3°
C4C3C6H1764.2°55.7°
C3C4H23H24121.5°123.2°
C3C4C5H25121.3°153.8°
C3C4C5H26117.7°82.5°
N2C1C5C417.8°37.1°
N2C1C5H27119.5°118.8°
N2C1C5H28119.4°118.8°
C1N2C3H1885.1°120.6°
C1N2C25H2057.8°179.1°
C1N2C25H2162.2°59.2°
C1N2C25H22177.8°60.9°
N2C1C5H25101.7°155.2°
N2C1C5H26137.3°81.0°
N2C1H27H28121.6°122.3°
C12N11C10C13179.6°180.0°
C10C13C14C15179.0°179.7°
C10C13C18H80.9°0.0°
C10C13C14H121.0°0.0°
N11C10C13C1442.2°35.0°
C10N11C12H13179.5°179.9°
C17C16C15H10180.0°180.0°
C17C16C15C140.2°0.4°
C16C17C18H8179.6°180.0°
C17C16C15H11179.7°180.0°
C13C14C15C160.3°0.6°
C13C14C15H12180.0°179.7°
C14C13C18H8179.1°179.7°
C13C14C15H11179.8°179.7°
C4C5C1H25119.5°118.1°
C4C5C1H26119.5°118.1°
C5C4C3H1897.1°97.2°
C5C4H23H24121.5°123.3°
C4C5H25H26121.6°123.8°
C4C5C1H27101.7°155.9°
C4C5C1H28137.2°81.8°
C1C5C4H23117.7°82.7°
C1C5C4H24121.3°154.0°
C1C5H25H26121.6°123.9°
C5C1H27H28121.7°122.3°
C16C15C14H11180.0°179.6°
C15C16C17H9179.8°179.9°
C16C15C14H12179.7°179.7°
C14C15C16H10179.8°179.6°
H2C21C20H30.9°0.0°
H4C28H5H6120.0°120.0°
H8C18C17H90.4°0.0°
H9C17C16H100.2°0.0°
H10C16C15H110.3°0.0°
H11C15C14H120.2°0.0°
H14C7C6H16155.8°175.6°
H14C7C6H1737.7°55.6°
H15C7C6H1637.7°64.4°
H15C7C6H1780.4°175.6°
H16C6C3H1856.5°174.6°
H17C6C3H18174.6°65.4°
H18C3C4H23143.4°144.5°
H18C3C4H2422.4°21.2°
H20C25H21H22120.0°119.9°
H23C4C5H251.8°35.5°
H23C4C5H26122.8°159.2°
H24C4C5H25119.2°87.9°
H24C4C5H261.8°35.9°
H25C5C1H27138.9°86.0°
H25C5C1H2817.8°36.3°
H26C5C1H2717.8°37.8°
H26C5C1H28103.3°160.1°

223532

PDB entries from 2024-08-07

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