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JEH

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C29C28sing1.53Å1.52Å
C31C32sing1.53Å1.53Å
C31N27sing1.47Å1.37Å
C32N24sing1.47Å1.36Å
C28N27sing1.47Å1.30Å
C28C30sing1.53Å1.53Å
N27C26sing1.47Å1.36Å
N24C23sing1.47Å1.30Å
N24C25sing1.47Å1.36Å
C23C22sing1.51Å1.58Å
C26C25sing1.53Å1.52Å
C21C22doub1.38Å1.40ÅAromatic
C21C20sing1.38Å1.41ÅAromatic
C22C33sing1.38Å1.40ÅAromatic
C20C19doub1.38Å1.40ÅAromatic
C33C34doub1.38Å1.40ÅAromatic
C19C34sing1.38Å1.39ÅAromatic
C19C18sing1.51Å1.55Å
C16C15doub1.34Å1.40ÅAromatic
C16N17sing1.37Å1.34ÅAromatic
C15C12sing1.46Å1.45ÅAromatic
N17C18sing1.47Å1.45Å
N17C11sing1.38Å1.39ÅAromatic
C12C11doub1.41Å1.38ÅAromatic
C12C13sing1.40Å1.43ÅAromatic
C11C10sing1.39Å1.43ÅAromatic
C13C14doub1.36Å1.41ÅAromatic
C10C09doub1.39Å1.41ÅAromatic
C14C09sing1.40Å1.40ÅAromatic
C09C05sing1.48Å1.53Å
N04C05doub1.31Å1.33ÅAromatic
N04N03sing1.40Å1.35ÅAromatic
C05C06sing1.47Å1.39ÅAromatic
C06C07sing1.43Å1.51Å
C06C02doub1.39Å1.39ÅAromatic
N03C02sing1.35Å1.36ÅAromatic
C07N08trip1.14Å1.14Å
C02N01sing1.38Å1.43Å
C10H1sing1.08Å1.08Å
C13H2sing1.08Å1.08Å
C15H3sing1.08Å1.08Å
C20H4sing1.08Å1.08Å
C21H5sing1.08Å1.08Å
C26H6sing1.09Å1.10Å
C26H7sing1.09Å1.10Å
C28H8sing1.09Å1.10Å
N01H9sing0.97Å1.00Å
N01H10sing0.97Å1.00Å
N03H11sing0.97Å1.00Å
C14H12sing1.08Å1.08Å
C16H13sing1.08Å1.08Å
C18H14sing1.09Å1.10Å
C18H15sing1.09Å1.10Å
C23H16sing1.09Å1.10Å
C23H17sing1.09Å1.10Å
C25H18sing1.09Å1.10Å
C25H19sing1.09Å1.10Å
C29H20sing1.09Å1.10Å
C29H21sing1.09Å1.10Å
C29H22sing1.09Å1.10Å
C30H23sing1.09Å1.10Å
C30H24sing1.09Å1.10Å
C30H25sing1.09Å1.10Å
C31H26sing1.09Å1.10Å
C32H27sing1.09Å1.10Å
C33H28sing1.08Å1.08Å
C34H29sing1.08Å1.08Å
C31H30sing1.09Å1.10Å
C32H31sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C29C28N27109.1°109.5°
C29C28C30111.4°109.5°
C29C28H8105.8°109.4°
C28C29H20109.5°109.5°
C28C29H21109.5°109.4°
C28C29H22109.5°109.5°
C32C31N27119.6°109.3°
C31C32N24115.4°109.4°
C32C31H26106.9°109.6°
C31C32H27108.0°109.5°
C32C31H30106.9°109.5°
C31C32H31108.0°109.4°
C31N27C28109.2°111.0°
C31N27C26117.6°110.9°
N27C31H26106.9°109.5°
N27C31H30106.9°109.4°
C32N24C23108.9°111.0°
C32N24C25107.3°110.9°
N24C32H27108.0°109.5°
N24C32H31107.9°109.5°
N27C28C30115.7°109.5°
C28N27C26113.5°111.0°
N27C28H8108.6°109.5°
C30C28H8105.7°109.5°
C28C30H23109.5°109.5°
C28C30H24109.5°109.5°
C28C30H25109.4°109.5°
N27C26C25115.1°109.4°
N27C26H6108.0°109.5°
N27C26H7108.0°109.5°
C23N24C25116.1°111.0°
N24C23C22118.5°109.4°
N24C23H16107.1°109.5°
N24C23H17107.2°109.4°
N24C25C26113.0°109.4°
N24C25H18108.6°109.5°
N24C25H19108.6°109.5°
C23C22C21118.9°120.0°
C23C22C33122.2°120.0°
C22C23H16107.2°109.5°
C22C23H17107.2°109.5°
C25C26H6108.1°109.5°
C25C26H7108.0°109.5°
C26C25H18108.6°109.5°
C26C25H19108.6°109.5°
C22C21C20120.1°120.0°
C21C22C33119.0°120.0°
C22C21H5119.9°120.0°
C21C20C19119.8°120.0°
C21C20H4120.1°120.0°
C20C21H5119.9°120.0°
C22C33C34121.2°120.0°
C22C33H28119.4°120.0°
C20C19C34120.5°120.0°
C20C19C18122.7°120.0°
C19C20H4120.1°120.0°
C33C34C19119.5°120.0°
C34C33H28119.4°120.0°
C33C34H29120.3°120.0°
C34C19C18116.8°120.0°
C19C34H29120.3°120.0°
C19C18N17114.5°109.4°
C19C18H14108.2°109.5°
C19C18H15108.2°109.4°
C15C16N17107.7°110.0°
C16C15C12108.1°107.0°
C16C15H3126.0°126.5°
C15C16H13126.1°125.1°
C16N17C18124.2°125.1°
C16N17C11110.4°109.8°
N17C16H13126.2°125.0°
C15C12C11104.9°106.0°
C15C12C13134.5°133.9°
C12C15H3126.0°126.5°
C18N17C11125.4°125.1°
N17C18H14108.2°109.5°
N17C18H15108.2°109.5°
N17C11C12108.9°107.2°
N17C11C10131.5°133.4°
C11C12C13120.6°120.1°
C12C11C10119.6°119.5°
C12C13C14119.8°119.9°
C12C13H2120.1°120.0°
C11C10C09119.4°119.7°
C11C10H1120.3°120.1°
C13C14C09119.4°120.5°
C14C13H2120.1°120.1°
C13C14H12120.3°119.8°
C10C09C14121.1°120.3°
C10C09C05116.9°119.8°
C09C10H1120.3°120.2°
C14C09C05121.6°119.8°
C09C14H12120.3°119.7°
C09C05N04121.5°126.4°
C09C05C06130.6°126.4°
C05N04N03110.5°109.4°
N04C05C06107.4°107.1°
N04N03C02107.8°109.7°
N04N03H11126.1°125.1°
C05C06C07130.3°126.8°
C05C06C02106.9°106.2°
C07C06C02122.7°126.9°
C06C07N08178.0°179.9°
C06C02N03107.4°107.6°
C06C02N01125.8°126.2°
N03C02N01126.8°126.2°
C02N03H11126.1°125.2°
C02N01H9109.5°120.0°
C02N01H10109.5°120.0°
H6C26H7109.5°109.5°
H9N01H10109.4°120.0°
H14C18H15109.5°109.5°
H16C23H17109.5°109.5°
H18C25H19109.5°109.5°
H20C29H21109.4°109.5°
H20C29H22109.5°109.5°
H21C29H22109.5°109.4°
H23C30H24109.5°109.5°
H23C30H25109.5°109.5°
H24C30H25109.5°109.5°
H26C31H30109.5°109.5°
H27C32H31109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C29C28N27C3183.0°176.2°
C29C28N27C30126.5°120.0°
C29C28N27H8114.9°120.0°
C29C28C30H8114.4°120.0°
C29C28N27C26143.7°60.0°
C28C29H20H21120.0°120.0°
C28C29H20H22120.0°120.0°
C28C29H21H22120.0°120.0°
C29C28C30H23180.0°180.0°
C29C28C30H2460.0°60.0°
C29C28C30H2560.0°60.0°
C32C31N27H26121.4°120.0°
C32C31N27H30121.4°119.9°
C31C32N24H27120.9°120.0°
C31C32N24H31120.9°119.9°
C32C31N27C28117.1°176.8°
C32C31N27C2614.0°59.4°
C31C32N24C2379.8°64.5°
C31C32N24C2546.6°59.4°
C32C31H26H30115.4°120.1°
C31C32H27H31117.3°120.0°
N27C31C32N247.8°58.5°
C31N27C28C26133.3°123.8°
C31N27C28C30150.5°56.2°
C31N27C26C253.5°59.3°
C31N27C26H6124.4°60.6°
C31N27C26H7117.3°179.3°
C31N27C28H831.8°63.8°
N27C31H26H30115.5°120.0°
N27C31C32H27128.6°61.6°
N27C31C32H31113.1°178.4°
C32N24C23C25121.1°123.8°
C32N24C23C22163.0°66.2°
C32N24C25C2665.8°59.3°
C32N24C23H1675.7°53.8°
C32N24C23H1741.8°173.8°
C32N24C25H18173.7°60.6°
C32N24C25H1954.7°179.3°
N24C32C31H26129.2°61.5°
N24C32H27H31117.3°120.1°
N24C32C31H30113.6°178.3°
N27C28C30H8120.2°120.0°
C28N27C26C25132.7°176.8°
C28N27C26H6106.5°63.2°
C28N27C26H711.8°56.9°
N27C28C29H20180.0°180.0°
N27C28C29H2160.0°59.9°
N27C28C29H2260.0°60.0°
N27C28C30H2354.7°60.0°
N27C28C30H2465.3°180.0°
N27C28C30H25174.7°60.0°
C28N27C31H26121.5°63.2°
C28N27C31H304.3°56.8°
C30C28N27C2617.2°180.0°
C30C28C29H2051.0°60.0°
C30C28C29H2169.0°180.0°
C30C28C29H22171.0°60.0°
C28C30H23H24120.0°120.0°
C28C30H23H25120.0°120.0°
C28C30H24H25120.0°120.0°
N27C26C25N2445.5°58.4°
N27C26C25H6120.8°120.0°
N27C26C25H7120.8°120.0°
N27C26H6H7117.4°120.1°
C26N27C28H8101.4°60.0°
N27C26C25H18166.0°61.6°
N27C26C25H1975.0°178.4°
C26N27C31H26107.4°60.7°
C26N27C31H30135.5°179.3°
N24C23C22H16121.3°120.0°
N24C23C22H17121.3°119.9°
C23N24C25C2656.2°64.5°
N24C23C22C21152.0°90.0°
N24C23C22C3329.4°90.0°
N24C23H16H17115.9°119.9°
C23N24C25H1864.3°175.5°
C23N24C25H19176.8°55.4°
C23N24C32H2741.1°175.5°
C23N24C32H31159.4°55.4°
C25N24C23C2275.8°170.0°
N24C25C26H18120.5°120.0°
N24C25C26H19120.5°120.0°
N24C25C26H6166.3°61.5°
N24C25C26H775.3°178.4°
C25N24C23H1645.5°70.0°
C25N24C23H17162.9°50.0°
N24C25H18H19118.4°120.1°
C25N24C32H27167.5°60.7°
C25N24C32H3174.3°179.3°
C23C22C21C33178.6°179.9°
C23C22C21C20179.2°180.0°
C23C22C33C34179.1°179.6°
C23C22C21H50.8°0.1°
C22C23H16H17115.9°120.1°
C23C22C33H280.9°0.1°
C25C26H6H7117.4°120.0°
C26C25H18H19118.4°120.0°
C22C21C20H5180.0°179.9°
C22C21C20C190.2°0.1°
C21C22C33C340.5°0.3°
C22C21C20H4179.8°179.7°
C21C22C23H1686.7°150.0°
C21C22C23H1730.7°29.9°
C21C22C33H28179.5°180.0°
C20C21C22C330.5°0.1°
C21C20C19H4180.0°179.8°
C21C20C19C340.2°0.2°
C21C20C19C18180.0°179.7°
C22C33C34H28180.0°179.7°
C22C33C34C190.2°0.6°
C33C22C21H5179.5°180.0°
C33C22C23H1691.9°30.0°
C33C22C23H17150.7°150.0°
C22C33C34H29179.8°180.0°
C20C19C34C330.2°0.6°
C20C19C34C18179.8°180.0°
C20C19C18N1724.0°90.1°
C19C20C21H5179.8°180.0°
C20C19C18H1496.7°29.9°
C20C19C18H15144.8°150.0°
C20C19C34H29179.8°179.9°
C33C34C19H29180.0°179.4°
C33C34C19C18180.0°179.4°
C34C19C18N17155.8°90.0°
C34C19C20H4179.8°180.0°
C34C19C18H1483.4°150.0°
C34C19C18H1535.1°30.0°
C19C34C33H28179.8°179.7°
C19C18N17C16101.6°95.1°
C19C18N17H14120.7°120.0°
C19C18N17H15120.7°119.9°
C19C18N17C1179.8°85.0°
C18C19C20H40.0°0.1°
C19C18H14H15117.7°120.0°
C18C19C34H290.0°0.0°
C15C16N17H13180.0°180.0°
C16C15C12H3180.0°180.0°
C15C16N17C18179.3°179.9°
C15C16N17C110.5°0.0°
C16C15C12C110.6°0.0°
C16C15C12C13180.0°180.0°
N17C16C15C120.7°0.0°
C16N17C18C11178.6°179.9°
C16N17C11C120.1°0.0°
C16N17C11C10179.8°180.0°
N17C16C15H3179.3°180.0°
C16N17C18H1419.1°24.9°
C16N17C18H15137.7°145.0°
C15C12C11N170.3°0.0°
C15C12C11C13179.5°180.0°
C15C12C11C10179.5°180.0°
C15C12C13C14179.2°179.8°
C15C12C13H20.9°0.2°
C12C15C16H13179.3°180.0°
C18N17C11C12178.9°179.9°
C18N17C11C101.4°0.1°
C18N17C16H130.7°0.1°
N17C18H14H15117.8°120.0°
N17C11C12C10179.7°180.0°
N17C11C12C13179.8°180.0°
N17C11C10C09178.6°180.0°
N17C11C10H11.5°0.3°
C11N17C16H13179.5°180.0°
C11N17C18H14159.5°155.0°
C11N17C18H1540.9°34.9°
C11C12C13C140.1°0.2°
C12C11C10C091.8°0.0°
C12C11C10H1178.2°179.7°
C11C12C13H2179.8°179.8°
C11C12C15H3179.4°180.0°
C13C12C11C100.0°0.0°
C12C13C14H2180.0°179.6°
C12C13C14C092.0°0.5°
C13C12C15H30.0°0.0°
C12C13C14H12178.0°180.0°
C11C10C09H1180.0°179.7°
C11C10C09C143.7°0.3°
C11C10C09C05176.3°179.7°
C13C14C09C103.8°0.5°
C13C14C09H12180.0°179.5°
C13C14C09C05176.0°179.5°
C10C09C14C05172.2°180.0°
C10C09C05N041.2°34.9°
C10C09C05C06172.2°145.3°
C10C09C14H12176.2°180.0°
C14C09C05N04171.4°145.1°
C14C09C05C060.4°34.7°
C14C09C10H1176.3°180.0°
C09C14C13H2178.0°180.0°
C09C05N04C06172.8°179.8°
C09C05N04N03175.8°180.0°
C09C05C06C077.5°0.2°
C09C05C06C02174.7°179.8°
C05C09C10H13.7°0.1°
C05C09C14H124.0°0.0°
N04C05C06C07179.5°179.9°
N04C05C06C022.7°0.3°
C05N04N03C022.0°0.1°
C05N04N03H11178.0°180.0°
N03N04C05C063.0°0.2°
N04N03C02C060.3°0.3°
N04N03C02H11180.0°179.9°
N04N03C02N01179.7°180.0°
C05C06C07C02177.5°179.6°
C05C06C02N031.5°0.4°
C05C06C07N08169.9°149.9°
C05C06C02N01177.9°179.9°
C07C06C02N03179.5°180.0°
C07C06C02N010.1°0.2°
C06C02N03N01179.4°179.8°
C02C06C07N087.6°30.6°
C06C02N01H9180.0°179.7°
C06C02N01H1060.0°0.2°
C06C02N03H11179.7°179.8°
N03C02N01H90.7°0.0°
N03C02N01H10120.7°179.9°
C02N01H9H10120.0°179.9°
N01C02N03H110.3°0.1°
H2C13C14H122.0°0.5°
H3C15C16H130.7°0.0°
H4C20C21H50.2°0.2°
H6C26C25H1873.2°178.5°
H6C26C25H1945.8°58.4°
H7C26C25H1845.2°58.4°
H7C26C25H19164.2°61.6°
H8C28C29H2063.4°60.0°
H8C28C29H21176.7°60.0°
H8C28C29H2256.6°180.0°
H8C28C30H2365.5°60.0°
H8C28C30H24174.5°60.0°
H8C28C30H2554.5°180.0°
H20C29H21H22120.0°120.0°
H23C30H24H25120.0°120.0°
H26C31C32H27109.9°178.5°
H26C31C32H318.4°58.4°
H27C32C31H307.2°58.3°
H28C33C34H290.2°0.3°
H30C31C32H31125.5°61.7°

222415

PDB entries from 2024-07-10

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