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I16

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N18C17sing1.47Å1.48Å
N18C19sing1.47Å1.53Å
C17C16sing1.53Å1.55Å
C19C20sing1.53Å1.56Å
C16C15sing1.53Å1.53Å
C20C15sing1.53Å1.53Å
C15C14sing1.53Å1.53Å
C14N13sing1.46Å1.49Å
N13C12sing1.39Å1.36Å
C12N11doub1.33Å1.38ÅAromatic
C12C21sing1.39Å1.40ÅAromatic
N11C10sing1.33Å1.42ÅAromatic
C21N22doub1.32Å1.40ÅAromatic
C24C25doub1.38Å1.41ÅAromatic
C24C23sing1.40Å1.44ÅAromatic
C25C26sing1.40Å1.44ÅAromatic
C10C23sing1.48Å1.56Å
C10C9doub1.40Å1.41ÅAromatic
C30O31sing1.34Å1.41ÅAromatic
C30C29doub1.36Å1.42ÅAromatic
C23C28doub1.40Å1.45ÅAromatic
N22C9sing1.33Å1.39ÅAromatic
C9C6sing1.48Å1.47Å
C26C29sing1.48Å1.48Å
C26C27doub1.39Å1.44ÅAromatic
O31C32sing1.34Å1.44ÅAromatic
C29C33sing1.47Å1.42ÅAromatic
C28C27sing1.38Å1.44ÅAromatic
C6C7doub1.39Å1.43ÅAromatic
C6C5sing1.39Å1.39ÅAromatic
C32C33doub1.34Å1.38ÅAromatic
C7C8sing1.38Å1.42ÅAromatic
C5C4doub1.38Å1.44ÅAromatic
C8C3doub1.38Å1.41ÅAromatic
C4C3sing1.38Å1.43ÅAromatic
C3C2sing1.51Å1.50Å
C2N1sing1.47Å1.48Å
N1H1sing1.01Å1.00Å
N1H2sing1.01Å1.00Å
C2H4sing1.09Å1.10Å
C2H5sing1.09Å1.10Å
C8H6sing1.08Å1.08Å
C7H7sing1.08Å1.08Å
C5H8sing1.08Å1.08Å
C4H9sing1.08Å1.08Å
C21H10sing1.08Å1.08Å
N13H11sing0.97Å1.00Å
C14H12sing1.09Å1.10Å
C14H13sing1.09Å1.10Å
C15H14sing1.09Å1.10Å
C20H15sing1.09Å1.10Å
C20H16sing1.09Å1.10Å
C19H17sing1.09Å1.10Å
C19H18sing1.09Å1.10Å
N18H19sing1.01Å1.00Å
C17H21sing1.09Å1.10Å
C17H22sing1.09Å1.10Å
C16H23sing1.09Å1.10Å
C16H24sing1.09Å1.10Å
C28H25sing1.08Å1.08Å
C27H26sing1.08Å1.08Å
C25H27sing1.08Å1.08Å
C24H28sing1.08Å1.08Å
C33H29sing1.08Å1.08Å
C32H30sing1.08Å1.08Å
C30H31sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C17N18C19116.5°111.2°
N18C17C16112.8°109.6°
C17N18H19107.7°111.0°
N18C17H21108.6°109.4°
N18C17H22108.6°109.5°
N18C19C20113.7°109.5°
N18C19H17108.4°109.5°
N18C19H18108.4°109.4°
C19N18H19107.7°110.9°
C17C16C15110.4°109.3°
C16C17H21108.6°109.4°
C16C17H22108.6°109.5°
C17C16H23109.2°109.5°
C17C16H24109.2°109.5°
C19C20C15112.3°109.3°
C19C20H15108.8°109.5°
C19C20H16108.8°109.6°
C20C19H17108.4°109.5°
C20C19H18108.4°109.5°
C16C15C20112.1°109.2°
C16C15C14109.1°109.5°
C16C15H14108.3°109.5°
C15C16H23109.2°109.4°
C15C16H24109.2°109.6°
C20C15C14110.9°109.6°
C20C15H14108.1°109.6°
C15C20H15108.7°109.5°
C15C20H16108.8°109.5°
C15C14N13106.4°109.5°
C15C14H12110.3°109.5°
C15C14H13110.2°109.4°
C14C15H14108.2°109.5°
C14N13C12118.9°120.0°
C14N13H11107.1°120.0°
N13C14H12110.2°109.5°
N13C14H13110.3°109.5°
N13C12N11118.0°119.9°
N13C12C21120.5°119.9°
C12N13H11107.1°120.0°
N11C12C21121.4°120.2°
C12N11C10122.9°119.9°
C12C21N22115.3°120.2°
C12C21H10122.4°119.9°
N11C10C23119.1°120.1°
N11C10C9116.3°119.7°
C21N22C9124.8°120.1°
N22C21H10122.3°119.9°
C25C24C23121.2°120.0°
C24C25C26118.9°120.0°
C24C25H27120.6°120.0°
C25C24H28119.4°120.0°
C24C23C10120.1°120.0°
C24C23C28118.3°120.0°
C23C24H28119.4°120.0°
C25C26C29120.6°120.0°
C25C26C27122.8°120.0°
C26C25H27120.6°120.0°
C23C10C9124.5°120.1°
C10C23C28121.6°120.0°
C10C9N22119.3°119.9°
C10C9C6121.9°120.0°
O31C30C29103.5°108.4°
C30O31C32108.6°110.8°
O31C30H31128.2°125.8°
C30C29C26122.4°127.1°
C30C29C33113.7°105.8°
C29C30H31128.2°125.8°
C23C28C27122.2°120.0°
C23C28H25118.9°120.0°
N22C9C6118.7°120.1°
C9C6C7116.7°120.2°
C9C6C5121.8°120.1°
C29C26C27116.6°120.0°
C26C29C33123.9°127.1°
C26C27C28116.8°120.0°
C26C27H26121.6°120.0°
O31C32C33110.4°109.0°
O31C32H30124.8°125.5°
C29C33C32103.7°106.0°
C29C33H29128.2°127.0°
C27C28H25118.9°120.0°
C28C27H26121.6°120.0°
C7C6C5121.5°119.7°
C6C7C8120.1°119.9°
C6C7H7120.0°120.0°
C6C5C4118.7°119.9°
C6C5H8120.7°120.1°
C32C33H29128.2°127.0°
C33C32H30124.8°125.5°
C7C8C3119.1°120.1°
C7C8H6120.4°119.9°
C8C7H7120.0°120.1°
C5C4C3119.7°120.1°
C4C5H8120.6°120.0°
C5C4H9120.2°120.0°
C8C3C4121.0°120.3°
C8C3C2118.2°119.9°
C3C8H6120.5°119.9°
C4C3C2120.9°119.9°
C3C4H9120.2°119.9°
C3C2N1110.1°109.5°
C3C2H4109.3°109.5°
C3C2H5109.3°109.5°
C2N1H1109.5°111.0°
C2N1H2109.5°111.0°
N1C2H4109.3°109.5°
N1C2H5109.3°109.4°
H1N1H2109.5°110.9°
H4C2H5109.5°109.5°
H12C14H13109.5°109.5°
H15C20H16109.5°109.5°
H17C19H18109.5°109.5°
H21C17H22109.5°109.5°
H23C16H24109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C17N18C19H19121.0°124.0°
N18C17C16H21120.5°120.0°
N18C17C16H22120.5°120.1°
C17N18C19C2042.0°61.7°
N18C17C16C1554.1°59.1°
C17N18C19H17162.7°58.3°
C17N18C19H1878.6°178.3°
N18C17H21H22118.5°119.9°
N18C17C16H23174.2°60.8°
N18C17C16H2466.0°179.1°
C19N18C17C1647.1°61.7°
N18C19C20H17120.6°120.0°
N18C19C20H18120.6°120.0°
N18C19C20C1543.8°59.2°
N18C19C20H1576.6°179.1°
N18C19C20H16164.2°60.8°
N18C19H17H18118.1°119.9°
C19N18C17H2173.4°58.3°
C19N18C17H22167.6°178.2°
C17C16C15H23120.1°119.9°
C17C16C15H24120.1°120.0°
C17C16C15C2057.6°57.5°
C17C16C15C14179.2°177.5°
C17C16C15H1461.6°62.4°
C16C17N18H1973.9°62.3°
C16C17H21H22118.5°120.0°
C17C16H23H24119.6°120.1°
C19C20C15C1652.9°57.7°
C19C20C15H15120.4°119.9°
C19C20C15H16120.4°120.1°
C19C20C15C14175.2°177.6°
C19C20C15H1466.4°62.3°
C19C20H15H16118.7°120.2°
C20C19H17H18118.1°120.0°
C20C19N18H1979.0°62.3°
C16C15C20C14122.2°119.9°
C16C15C20H14119.3°119.9°
C16C15C14H14117.6°120.1°
C16C15C14N1377.7°65.1°
C16C15C14H1241.8°174.9°
C16C15C14H13162.8°54.9°
C16C15C20H1567.5°177.6°
C16C15C20H16173.3°62.4°
C15C16C17H2166.4°60.9°
C15C16C17H22174.6°179.1°
C15C16H23H24119.6°120.2°
C20C15C14H14118.4°120.2°
C20C15C14N13158.4°175.2°
C20C15C14H1282.1°55.2°
C20C15C14H1338.8°64.9°
C15C20H15H16118.7°120.0°
C15C20C19H17164.4°60.8°
C15C20C19H1876.8°179.2°
C20C15C16H23177.7°62.3°
C20C15C16H2462.6°177.6°
C15C14N13H12119.5°120.0°
C15C14N13H13119.5°119.9°
C15C14N13C12120.3°180.0°
C15C14N13H111.0°0.0°
C15C14H12H13121.4°120.0°
C14C15C20H1554.7°62.5°
C14C15C20H1664.4°57.5°
C14C15C16H2359.1°57.6°
C14C15C16H2460.7°62.5°
C14N13C12H11121.3°180.0°
C14N13C12N113.1°180.0°
C14N13C12C21177.0°0.3°
N13C14H12H13121.5°120.0°
N13C14C15H1439.9°55.0°
N13C12N11C21179.9°179.7°
N13C12N11C10179.4°180.0°
N13C12C21N22178.6°179.7°
N13C12C21H101.4°0.3°
C12N13C14H12120.2°60.0°
C12N13C14H130.8°60.1°
N11C12C21N221.3°0.0°
C12N11C10C23179.0°180.0°
C12N11C10C92.9°0.6°
N11C12C21H10178.7°180.0°
N11C12N13H11118.3°0.0°
C21C12N11C100.6°0.3°
C12C21N22H10180.0°180.0°
C12C21N22C90.9°0.0°
C21C12N13H1161.7°179.7°
N11C10C23C2422.4°135.0°
N11C10C23C9175.7°179.4°
N11C10C23C28153.8°44.7°
N11C10C9N223.2°0.6°
N11C10C9C6179.4°179.7°
C21N22C9C101.4°0.3°
C21N22C9C6177.7°180.0°
C25C24C23H28180.0°179.5°
C24C25C26H27180.0°179.7°
C25C24C23C10178.5°179.8°
C25C24C23C282.2°0.5°
C24C25C26C29179.6°179.8°
C24C25C26C271.2°0.2°
C23C24C25C260.7°0.5°
C24C23C10C28176.2°179.7°
C24C23C10C9161.9°45.6°
C24C23C28C271.9°0.2°
C24C23C28H25178.1°179.7°
C23C24C25H27179.3°179.7°
C25C26C29C3030.6°179.7°
C25C26C29C27179.2°180.0°
C25C26C29C33149.6°0.0°
C25C26C27C281.4°0.1°
C25C26C27H26178.6°179.9°
C26C25C24H28179.3°180.0°
C23C10C9N22179.0°180.0°
C23C10C9C64.8°0.3°
C10C23C28C27178.2°180.0°
C10C23C28H251.8°0.0°
C10C23C24H281.5°0.2°
C9C10C23C2821.9°134.7°
C10C9N22C6176.3°179.7°
C10C9C6C765.3°45.1°
C10C9C6C5115.8°134.9°
O31C30C29H31180.0°179.6°
O31C30C29C26178.9°179.8°
O31C30C29C330.9°0.4°
C30O31C32C330.2°0.2°
C30O31C32H30179.8°179.7°
C30C29C26C33179.8°179.7°
C30C29C26C27148.6°0.3°
C29C30O31C320.6°0.4°
C30C29C33C320.8°0.3°
C30C29C33H29179.2°179.8°
C23C28C27C260.1°0.1°
C23C28C27H25180.0°180.0°
C23C28C27H26179.9°179.9°
C28C23C24H28177.9°180.0°
N22C9C6C7111.0°135.2°
N22C9C6C568.0°44.9°
C9N22C21H10179.1°180.0°
C9C6C7C5179.0°180.0°
C9C6C7C8179.8°180.0°
C9C6C5C4179.0°179.8°
C9C6C7H70.3°0.0°
C9C6C5H81.0°0.0°
C29C26C27C28179.4°179.9°
C26C29C33C32179.0°180.0°
C29C26C27H260.7°0.1°
C29C26C25H270.3°0.0°
C26C29C33H291.0°0.0°
C26C29C30H311.1°0.2°
C27C26C29C3331.2°180.0°
C26C27C28H26180.0°179.9°
C26C27C28H25179.8°180.0°
C27C26C25H27178.8°180.0°
O31C32C33C290.4°0.0°
O31C32C33H30180.0°180.0°
O31C32C33H29179.6°180.0°
C32O31C30H31179.4°179.9°
C29C33C32H29180.0°179.9°
C29C33C32H30179.7°180.0°
C33C29C30H31179.1°179.9°
C6C7C8H7180.0°180.0°
C7C6C5C42.1°0.2°
C6C7C8C31.5°0.1°
C6C7C8H6178.5°180.0°
C7C6C5H8177.9°180.0°
C5C6C7C80.8°0.0°
C6C5C4H8180.0°179.8°
C6C5C4C31.2°0.5°
C5C6C7H7179.2°180.0°
C6C5C4H9178.9°180.0°
C7C8C3H6180.0°179.9°
C7C8C3C42.4°0.3°
C7C8C3C2177.7°179.9°
C5C4C3C81.1°0.5°
C5C4C3H9180.0°179.5°
C5C4C3C2179.0°179.7°
C8C3C4C2179.9°179.7°
C8C3C2N1177.4°90.1°
C8C3C2H457.3°30.0°
C8C3C2H562.5°150.0°
C3C8C7H7178.5°180.0°
C8C3C4H9178.9°179.9°
C4C3C2N12.5°90.2°
C4C3C2H4122.6°149.7°
C4C3C2H5117.6°29.7°
C4C3C8H6177.6°179.8°
C3C4C5H8178.8°179.7°
C3C2N1H4120.1°120.1°
C3C2N1H5120.1°120.0°
C3C2N1H1180.0°180.0°
C3C2N1H260.0°56.1°
C3C2H4H5119.7°120.0°
C2C3C8H62.3°0.0°
C2C3C4H91.0°0.2°
C2N1H1H2120.0°123.9°
N1C2H4H5119.7°120.0°
H1N1C2H459.9°59.9°
H1N1C2H559.9°60.1°
H2N1C2H4179.9°63.9°
H2N1C2H560.1°176.1°
H6C8C7H71.5°0.0°
H8C5C4H91.1°0.2°
H11N13C14H12118.5°119.9°
H11N13C14H13120.5°120.0°
H12C14C15H14159.4°65.0°
H13C14C15H1479.6°174.9°
H14C15C20H15173.2°57.7°
H14C15C20H1654.0°177.7°
H14C15C16H2358.5°177.7°
H14C15C16H24178.2°57.6°
H15C20C19H1744.1°59.1°
H15C20C19H18162.8°60.9°
H16C20C19H1775.1°179.2°
H16C20C19H1843.6°59.2°
H17C19N18H1941.6°177.7°
H18C19N18H19160.4°57.7°
H19N18C17H21165.6°177.7°
H19N18C17H2246.6°57.8°
H21C17C16H2353.7°179.3°
H21C17C16H24173.5°59.2°
H22C17C16H2365.3°59.3°
H22C17C16H2454.4°60.8°
H25C28C27H260.2°0.1°
H27C25C24H280.7°0.2°
H29C33C32H300.4°0.1°

222624

PDB entries from 2024-07-17

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