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N44

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C3doub1.38Å1.38ÅAromatic
C1C4sing1.38Å1.38ÅAromatic
C2C5doub1.38Å1.37ÅAromatic
C2C6sing1.38Å1.38ÅAromatic
C3C7sing1.38Å1.38ÅAromatic
C4C8doub1.38Å1.38ÅAromatic
C5C9sing1.38Å1.38ÅAromatic
C6C12doub1.40Å1.38ÅAromatic
C7C14doub1.38Å1.38ÅAromatic
C8C14sing1.38Å1.38ÅAromatic
C9C15doub1.38Å1.38ÅAromatic
C10C11doub1.38Å1.39ÅAromatic
C10C16sing1.38Å1.40ÅAromatic
C11C17sing1.39Å1.38ÅAromatic
C12C15sing1.40Å1.39ÅAromatic
C12C21sing1.48Å1.49Å
C13C16doub1.40Å1.40ÅAromatic
C13C18sing1.40Å1.39ÅAromatic
C13C22sing1.47Å1.51Å
C14C24sing1.51Å1.50Å
C15C25sing1.51Å1.49Å
C16C26sing1.51Å1.50Å
C17C18doub1.39Å1.37ÅAromatic
C17O33sing1.36Å1.37Å
C18O34sing1.36Å1.40Å
C19C20doub1.31Å1.34Å
C20C27sing1.51Å1.49Å
C21N28sing1.35Å1.39Å
C21O31doub1.22Å1.22Å
C22O30doub1.22Å1.26Å
C22O32sing1.22Å1.27Å
C23O33sing1.44Å1.45Å
C23O34sing1.44Å1.44Å
C24N28sing1.47Å1.45Å
C25N29sing1.47Å1.49Å
C26N29sing1.47Å1.51Å
C27N29sing1.47Å1.50Å
C1H1sing1.08Å1.08Å
C2H2sing1.08Å1.08Å
C3H3sing1.08Å1.08Å
C4H4sing1.08Å1.08Å
C5H5sing1.08Å1.08Å
C6H6sing1.08Å1.08Å
C7H7sing1.08Å1.08Å
C8H8sing1.08Å1.08Å
C9H9sing1.08Å1.08Å
C10H10sing1.08Å1.08Å
C11H11sing1.08Å1.08Å
C19H19sing1.08Å1.08Å
C19H19Asing1.08Å1.08Å
C20H20sing1.08Å1.08Å
C23H23sing1.09Å1.10Å
C23H23Asing1.09Å1.10Å
C24H24sing1.09Å1.10Å
C24H24Asing1.09Å1.10Å
C25H25sing1.09Å1.10Å
C25H25Asing1.09Å1.10Å
C26H26sing1.09Å1.10Å
C26H26Asing1.09Å1.10Å
C27H27sing1.09Å1.10Å
C27H27Asing1.09Å1.10Å
N28HN28sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C3C1C4119.6°120.0°
C1C3C7120.1°120.0°
C3C1H1120.2°120.0°
C1C3H3120.0°120.0°
C1C4C8120.1°120.0°
C4C1H1120.2°120.0°
C1C4H4120.0°120.0°
C5C2C6120.6°120.2°
C2C5C9118.7°120.3°
C5C2H2119.7°119.9°
C2C5H5120.7°119.9°
C2C6C12120.8°119.9°
C6C2H2119.7°119.9°
C2C6H6119.6°120.1°
C3C7C14120.7°120.0°
C7C3H3120.0°120.0°
C3C7H7119.6°119.9°
C4C8C14120.4°120.0°
C8C4H4119.9°120.0°
C4C8H8119.8°120.0°
C5C9C15121.2°120.2°
C9C5H5120.6°119.9°
C5C9H9119.4°119.9°
C6C12C15118.7°119.7°
C6C12C21119.2°120.1°
C12C6H6119.6°120.1°
C7C14C8119.0°120.0°
C7C14C24120.5°120.0°
C14C7H7119.6°120.1°
C8C14C24120.5°120.0°
C14C8H8119.8°120.0°
C9C15C12119.9°119.8°
C9C15C25117.7°120.1°
C15C9H9119.4°119.9°
C11C10C16121.4°120.4°
C10C11C17116.7°120.4°
C11C10H10119.3°119.8°
C10C11H11121.7°119.8°
C10C16C13121.3°120.0°
C10C16C26117.6°120.0°
C16C10H10119.3°119.8°
C11C17C18122.4°119.9°
C11C17O33124.6°131.5°
C17C11H11121.7°119.7°
C15C12C21122.0°120.1°
C12C15C25122.4°120.1°
C12C21N28118.4°120.0°
C12C21O31119.2°120.0°
C16C13C18116.2°119.7°
C16C13C22122.4°120.1°
C13C16C26121.1°120.0°
C18C13C22121.4°120.2°
C13C18C17122.0°119.7°
C13C18O34126.6°131.6°
C13C22O30116.4°120.0°
C13C22O32120.5°119.9°
C14C24N28111.0°109.5°
C14C24H24109.0°109.5°
C14C24H24A109.0°109.5°
C15C25N29115.3°109.5°
C15C25H25107.6°109.5°
C15C25H25A107.5°109.5°
C16C26N29110.5°109.5°
C16C26H26109.1°109.5°
C16C26H26A109.1°109.5°
C18C17O33113.0°108.6°
C17C18O34111.5°108.8°
C17O33C23100.8°105.5°
C18O34C23100.8°105.5°
C19C20C27121.9°120.0°
C20C19H19120.0°120.0°
C20C19H19A120.0°120.0°
C19C20H20119.1°120.0°
C20C27N29114.5°109.5°
C27C20H20119.1°120.0°
C20C27H27107.9°109.5°
C20C27H27A107.8°109.5°
N28C21O31122.4°120.0°
C21N28C24120.3°120.0°
C21N28HN28119.9°120.0°
O30C22O32123.1°120.0°
O33C23O34113.9°103.7°
O33C23H23108.0°110.6°
O33C23H23A108.0°110.5°
O34C23H23108.0°110.6°
O34C23H23A108.0°110.6°
N28C24H24109.0°109.4°
N28C24H24A109.0°109.5°
C24N28HN28119.8°119.9°
C25N29C26116.1°111.0°
C25N29C27111.5°111.0°
N29C25H25107.6°109.4°
N29C25H25A107.6°109.5°
C26N29C27115.7°111.0°
N29C26H26109.1°109.5°
N29C26H26A109.2°109.5°
N29C27H27107.8°109.4°
N29C27H27A107.8°109.5°
H19C19H19A120.0°120.0°
H23C23H23A110.9°110.7°
H24C24H24A109.9°109.5°
H25C25H25A111.3°109.4°
H26C26H26A109.8°109.5°
H27C27H27A111.0°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C3C1C4H1180.0°179.7°
C1C3C7H3180.0°179.9°
C3C1C4C81.1°0.0°
C1C3C7C140.2°0.0°
C3C1C4H4178.9°179.9°
C1C3C7H7179.8°179.9°
C4C1C3C70.7°0.0°
C1C4C8H4180.0°179.9°
C1C4C8C140.6°0.0°
C4C1C3H3179.3°179.9°
C1C4C8H8179.4°180.0°
C5C2C6H2180.0°179.7°
C2C5C9H5180.0°179.9°
C5C2C6C120.0°0.0°
C2C5C9C150.2°0.1°
C5C2C6H6180.0°180.0°
C2C5C9H9179.8°180.0°
C6C2C5C90.2°0.0°
C2C6C12H6180.0°180.0°
C2C6C12C150.3°0.0°
C2C6C12C21179.7°180.0°
C6C2C5H5179.8°180.0°
C3C7C14H7180.0°180.0°
C3C7C14C80.7°0.0°
C3C7C14C24179.1°180.0°
C7C3C1H1179.3°179.7°
C4C8C14C70.3°0.0°
C4C8C14H8180.0°180.0°
C4C8C14C24179.5°179.9°
C8C4C1H1178.9°179.7°
C5C9C15H9180.0°179.9°
C5C9C15C120.1°0.1°
C5C9C15C25179.8°180.0°
C9C5C2H2179.7°179.7°
C6C12C15C90.3°0.0°
C6C12C15C21179.4°180.0°
C6C12C15C25179.6°180.0°
C6C12C21N2843.2°0.0°
C6C12C21O31136.3°180.0°
C12C6C2H2180.0°179.7°
C7C14C8C24179.9°179.9°
C7C14C24N2897.9°90.0°
C14C7C3H3179.8°180.0°
C7C14C8H8179.7°180.0°
C7C14C24H2422.1°150.0°
C7C14C24H24A142.1°30.0°
C8C14C24N2882.0°90.1°
C14C8C4H4179.4°179.9°
C8C14C7H7179.2°179.9°
C8C14C24H24158.0°29.9°
C8C14C24H24A38.0°149.9°
C9C15C12C25179.9°180.0°
C9C15C12C21179.7°179.9°
C9C15C25N2979.9°100.0°
C15C9C5H5179.8°180.0°
C9C15C25H2540.1°20.0°
C9C15C25H25A160.1°139.9°
C11C10C16H10180.0°179.7°
C10C11C17H11180.0°180.0°
C11C10C16C130.4°0.0°
C11C10C16C26179.7°180.0°
C10C11C17C180.2°0.0°
C10C11C17O33179.7°180.0°
C16C10C11C170.2°0.0°
C10C16C13C26179.3°180.0°
C10C16C13C180.5°0.0°
C10C16C13C22179.1°180.0°
C10C16C26N29107.6°99.9°
C16C10C11H11179.8°180.0°
C10C16C26H26132.4°20.1°
C10C16C26H26A12.4°140.1°
C11C17C18C130.3°0.0°
C11C17C18O33179.9°180.0°
C11C17C18O34179.6°180.0°
C11C17O33C23179.9°162.7°
C17C11C10H10179.7°179.7°
C15C12C21N28137.4°180.0°
C15C12C21O3143.1°0.1°
C12C15C25N29100.3°80.0°
C15C12C6H6179.8°180.0°
C12C15C9H9179.9°180.0°
C12C15C25H25139.7°160.0°
C12C15C25H25A19.7°40.0°
C21C12C15C250.2°0.0°
C12C21N28O31179.5°179.9°
C12C21N28C24179.5°180.0°
C21C12C6H60.3°0.1°
C12C21N28HN280.5°0.0°
C16C13C18C22178.6°180.0°
C16C13C18C170.5°0.0°
C16C13C18O34179.7°180.0°
C16C13C22O30147.5°5.5°
C16C13C22O3230.3°174.5°
C13C16C26N2971.8°80.1°
C13C16C10H10179.6°179.7°
C13C16C26H2648.3°160.0°
C13C16C26H26A168.2°40.0°
C18C13C16C26179.8°180.0°
C13C18C17O34179.3°180.0°
C13C18C17O33179.6°180.0°
C18C13C22O3031.1°174.5°
C18C13C22O32151.2°5.5°
C13C18O34C23179.7°162.7°
C22C13C16C261.6°0.0°
C22C13C18C17179.1°180.0°
C22C13C18O341.7°0.0°
C13C22O30O32177.7°180.0°
C14C24N28C21102.6°180.0°
C14C24N28H24120.0°120.0°
C14C24N28H24A120.0°120.1°
C24C14C7H70.9°0.0°
C24C14C8H80.5°0.1°
C14C24H24H24A119.4°120.1°
C14C24N28HN2877.4°0.1°
C15C25N29H25120.0°120.0°
C15C25N29H25A120.0°120.1°
C15C25N29C2671.4°170.0°
C15C25N29C27153.2°66.0°
C25C15C9H90.2°0.1°
C15C25H25H25A117.6°120.0°
C16C26N29C25172.8°64.1°
C16C26N29H26120.0°120.0°
C16C26N29H26A120.0°120.0°
C16C26N29C2739.2°171.9°
C26C16C10H100.2°0.2°
C16C26H26H26A119.6°120.0°
C18C17O33C230.1°17.3°
C17C18O34C230.4°17.3°
C18C17C11H11179.9°180.0°
O33C17C18O340.2°0.0°
C17O33C23O340.3°27.1°
O33C17C11H110.3°0.0°
C17O33C23H23120.4°145.6°
C17O33C23H23A119.7°91.4°
C18O34C23O330.5°27.1°
C18O34C23H23120.5°145.6°
C18O34C23H23A119.5°91.4°
C19C20C27H20180.0°179.9°
C19C20C27N29107.0°124.0°
C20C19H19H19A180.0°179.9°
C19C20C27H2713.0°116.0°
C19C20C27H27A133.0°3.9°
C20C27N29C2568.6°165.0°
C20C27N29C2667.0°71.1°
C20C27N29H27120.0°120.0°
C20C27N29H27A120.0°120.0°
C27C20C19H190.0°0.1°
C27C20C19H19A180.0°180.0°
C20C27H27H27A118.0°120.0°
C21N28C24HN28180.0°180.0°
C21N28C24H24137.4°60.0°
C21N28C24H24A17.5°60.0°
O31C21N28C240.1°0.0°
O31C21N28HN28179.9°179.9°
O33C23O34H23120.0°118.5°
O33C23O34H23A120.0°118.5°
O33C23H23H23A118.2°122.8°
O34C23H23H23A118.2°122.9°
N28C24H24H24A119.3°119.9°
C25N29C26C27133.6°124.0°
N29C25H25H25A117.6°120.0°
C25N29C26H2667.2°55.9°
C25N29C26H26A52.8°175.9°
C25N29C27H2751.4°75.1°
C25N29C27H27A171.4°44.9°
C26N29C25H25168.6°70.0°
C26N29C25H25A48.6°50.0°
N29C26H26H26A119.6°120.0°
C26N29C27H27172.9°48.9°
C26N29C27H27A53.0°168.9°
N29C27C20H2073.0°55.9°
C27N29C25H2533.2°54.0°
C27N29C25H25A86.8°173.9°
C27N29C26H26159.2°68.1°
C27N29C26H26A80.8°51.9°
N29C27H27H27A117.9°120.0°
H1C1C3H30.7°0.3°
H1C1C4H41.1°0.2°
H2C2C5H50.3°0.2°
H2C2C6H60.1°0.3°
H3C3C7H70.2°0.0°
H4C4C8H80.6°0.1°
H5C5C9H90.2°0.1°
H10C10C11H110.2°0.3°
H19C19C20H20180.0°180.0°
H19AC19C20H200.0°0.1°
H20C20C27H27167.0°64.0°
H20C20C27H27A47.1°176.0°
H24C24N28HN2842.6°120.0°
H24AC24N28HN28162.5°120.0°

223532

PDB entries from 2024-08-07

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