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JDH

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C27C26sing1.53Å1.52Å
C27N21sing1.47Å1.36Å
C25N24sing1.47Å1.29Å
C26N24sing1.47Å1.36Å
N24C23sing1.47Å1.36Å
C20N21sing1.47Å1.31Å
C20C19sing1.51Å1.59Å
N21C22sing1.47Å1.35Å
C22C23sing1.53Å1.52Å
C18C19doub1.38Å1.40ÅAromatic
C18C17sing1.38Å1.41ÅAromatic
C19C28sing1.38Å1.42ÅAromatic
C17C16doub1.38Å1.40ÅAromatic
C28C29doub1.38Å1.41ÅAromatic
C16C29sing1.38Å1.41ÅAromatic
C16C15sing1.51Å1.52Å
C13C12doub1.34Å1.40ÅAromatic
C13N14sing1.37Å1.34ÅAromatic
C12C09sing1.46Å1.44ÅAromatic
N14C15sing1.47Å1.44Å
N14C08sing1.38Å1.37ÅAromatic
C09C08doub1.41Å1.39ÅAromatic
C09C10sing1.40Å1.42ÅAromatic
C08C07sing1.39Å1.43ÅAromatic
C10C11doub1.36Å1.41ÅAromatic
C07C06doub1.39Å1.40ÅAromatic
C11C06sing1.40Å1.42ÅAromatic
C06C05sing1.48Å1.55Å
N04C05doub1.31Å1.35ÅAromatic
N04N03sing1.40Å1.36ÅAromatic
C05C30sing1.47Å1.39ÅAromatic
C30C31sing1.43Å1.50Å
C30C02doub1.39Å1.41ÅAromatic
N03C02sing1.35Å1.36ÅAromatic
C31N32trip1.14Å1.12Å
C02N01sing1.38Å1.44Å
C10H1sing1.08Å1.08Å
C13H2sing1.08Å1.08Å
C15H3sing1.09Å1.10Å
C15H4sing1.09Å1.10Å
C17H5sing1.08Å1.08Å
C20H6sing1.09Å1.10Å
C20H7sing1.09Å1.10Å
C22H8sing1.09Å1.10Å
C22H9sing1.09Å1.10Å
C26H10sing1.09Å1.10Å
C26H11sing1.09Å1.10Å
C28H12sing1.08Å1.08Å
N01H13sing0.97Å1.00Å
N01H14sing0.97Å1.00Å
N03H15sing0.97Å1.00Å
C07H16sing1.08Å1.08Å
C11H17sing1.08Å1.08Å
C12H18sing1.08Å1.08Å
C18H19sing1.08Å1.08Å
C23H21sing1.09Å1.10Å
C23H22sing1.09Å1.10Å
C25H24sing1.09Å1.10Å
C25H25sing1.09Å1.10Å
C25H26sing1.09Å1.10Å
C27H27sing1.09Å1.10Å
C27H28sing1.09Å1.10Å
C29H29sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C26C27N21112.6°109.3°
C27C26N24115.4°109.3°
C27C26H10108.0°109.5°
C27C26H11108.0°109.6°
C26C27H27108.7°109.5°
C26C27H28108.7°109.5°
C27N21C20109.9°111.0°
C27N21C22110.2°110.9°
N21C27H27108.7°109.5°
N21C27H28108.7°109.5°
C25N24C26112.7°111.0°
C25N24C23112.2°111.0°
N24C25H24109.5°109.4°
N24C25H25109.4°109.4°
N24C25H26109.5°109.5°
C26N24C23116.2°110.9°
N24C26H10107.9°109.5°
N24C26H11108.0°109.5°
N24C23C22114.3°109.4°
N24C23H21108.3°109.5°
N24C23H22108.2°109.5°
N21C20C19112.4°109.5°
C20N21C22110.4°111.0°
N21C20H6108.7°109.5°
N21C20H7108.7°109.5°
C20C19C18118.7°120.0°
C20C19C28122.0°120.0°
C19C20H6108.7°109.4°
C19C20H7108.7°109.5°
N21C22C23112.4°109.3°
N21C22H8108.7°109.5°
N21C22H9108.7°109.5°
C23C22H8108.7°109.5°
C23C22H9108.8°109.5°
C22C23H21108.2°109.5°
C22C23H22108.3°109.5°
C19C18C17120.8°120.0°
C18C19C28119.3°120.0°
C19C18H19119.6°120.0°
C18C17C16120.1°120.0°
C18C17H5119.9°120.0°
C17C18H19119.6°120.0°
C19C28C29119.8°120.0°
C19C28H12120.1°120.0°
C17C16C29119.6°120.0°
C17C16C15120.8°120.0°
C16C17H5120.0°120.0°
C28C29C16120.4°120.0°
C29C28H12120.1°120.0°
C28C29H29119.8°120.0°
C29C16C15119.6°120.0°
C16C29H29119.8°120.0°
C16C15N14113.9°109.4°
C16C15H3108.4°109.5°
C16C15H4108.4°109.5°
C12C13N14107.6°110.0°
C13C12C09108.1°107.0°
C12C13H2126.2°125.0°
C13C12H18126.0°126.5°
C13N14C15125.3°125.1°
C13N14C08110.3°109.9°
N14C13H2126.2°125.1°
C12C09C08104.8°106.0°
C12C09C10135.6°133.9°
C09C12H18126.0°126.5°
C15N14C08124.3°125.1°
N14C15H3108.4°109.4°
N14C15H4108.4°109.5°
N14C08C09109.2°107.2°
N14C08C07131.1°133.3°
C08C09C10119.7°120.1°
C09C08C07119.7°119.5°
C09C10C11120.7°120.0°
C09C10H1119.7°120.0°
C08C07C06120.8°119.6°
C08C07H16119.6°120.2°
C10C11C06119.3°120.4°
C11C10H1119.7°120.0°
C10C11H17120.4°119.8°
C07C06C11119.8°120.4°
C07C06C05116.8°119.8°
C06C07H16119.6°120.2°
C11C06C05122.8°119.9°
C06C11H17120.3°119.8°
C06C05N04123.3°126.4°
C06C05C30129.0°126.4°
C05N04N03110.4°109.4°
N04C05C30107.0°107.1°
N04N03C02108.2°109.7°
N04N03H15125.9°125.1°
C05C30C31129.7°126.9°
C05C30C02107.2°106.3°
C31C30C02123.1°126.9°
C30C31N32176.8°180.0°
C30C02N03107.1°107.6°
C30C02N01126.1°126.2°
N03C02N01126.8°126.2°
C02N03H15125.9°125.2°
C02N01H13109.5°120.0°
C02N01H14109.5°120.0°
H3C15H4109.4°109.5°
H6C20H7109.5°109.5°
H8C22H9109.5°109.5°
H10C26H11109.5°109.5°
H13N01H14109.5°120.0°
H21C23H22109.5°109.5°
H24C25H25109.4°109.5°
H24C25H26109.5°109.5°
H25C25H26109.5°109.5°
H27C27H28109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C26C27N21H27120.5°119.9°
C26C27N21H28120.5°120.0°
C27C26N24C2595.5°64.6°
C27C26N24H10120.9°119.9°
C27C26N24H11120.9°120.0°
C27C26N24C2335.9°59.3°
C26C27N21C20178.0°176.8°
C26C27N21C2256.2°59.4°
C27C26H10H11117.4°120.1°
C26C27H27H28118.6°120.1°
N21C27C26N2445.3°58.4°
C27N21C20C22121.7°123.8°
C27N21C20C19179.5°66.1°
C27N21C22C2358.2°59.3°
C27N21C20H659.0°53.8°
C27N21C20H760.1°173.8°
C27N21C22H862.2°60.6°
C27N21C22H9178.7°179.3°
N21C27C26H1075.5°178.3°
N21C27C26H11166.2°61.6°
N21C27H27H28118.6°120.1°
C25N24C26C23131.4°123.9°
C25N24C23C2294.2°64.6°
C25N24C26H10143.6°55.4°
C25N24C26H1125.4°175.4°
C25N24C23H21145.1°55.5°
C25N24C23H2226.5°175.5°
N24C25H24H25119.9°120.0°
N24C25H24H26120.0°120.0°
N24C25H25H26120.0°120.0°
C26N24C23C2237.5°59.3°
N24C26H10H11117.3°120.0°
C26N24C23H2183.2°179.4°
C26N24C23H22158.1°60.6°
C26N24C25H24180.0°60.0°
C26N24C25H2560.0°180.0°
C26N24C25H2660.0°60.0°
N24C26C27H2775.2°61.6°
N24C26C27H28165.8°178.4°
N24C23C22N2149.1°58.4°
N24C23C22H21120.7°120.0°
N24C23C22H22120.7°120.0°
N24C23C22H871.4°61.6°
N24C23C22H9169.5°178.4°
C23N24C26H1084.9°179.3°
C23N24C26H11156.8°60.7°
N24C23H21H22117.8°120.0°
C23N24C25H2446.6°63.8°
C23N24C25H25166.6°56.2°
C23N24C25H2673.4°176.2°
N21C20C19H6120.4°119.9°
N21C20C19H7120.4°120.0°
C20N21C22C23179.8°176.8°
N21C20C19C18136.8°90.0°
N21C20C19C2844.0°89.9°
N21C20H6H7118.7°120.0°
C20N21C22H859.3°63.2°
C20N21C22H959.8°56.9°
C20N21C27H2757.6°63.2°
C20N21C27H2861.5°56.8°
C19C20N21C2257.8°170.0°
C20C19C18C28179.2°179.9°
C20C19C18C17180.0°180.0°
C20C19C28C29179.8°179.7°
C19C20H6H7118.6°120.0°
C20C19C28H120.2°0.2°
C20C19C18H190.0°0.1°
N21C22C23H8120.4°120.0°
N21C22C23H9120.4°120.0°
C22N21C20H662.7°70.0°
C22N21C20H7178.2°50.0°
N21C22H8H9118.6°120.1°
N21C22C23H2171.6°178.4°
N21C22C23H22169.8°61.6°
C22N21C27H2764.3°60.6°
C22N21C27H28176.7°179.3°
C23C22H8H9118.7°120.0°
C22C23H21H22117.8°120.0°
C19C18C17H19180.0°179.9°
C19C18C17C160.8°0.0°
C18C19C28C290.7°0.2°
C19C18C17H5179.2°179.6°
C18C19C20H616.4°150.0°
C18C19C20H7102.7°30.0°
C18C19C28H12179.3°179.7°
C17C18C19C280.9°0.1°
C18C17C16H5180.0°179.7°
C18C17C16C290.5°0.3°
C18C17C16C15178.9°179.8°
C19C28C29H12180.0°179.5°
C19C28C29C160.4°0.5°
C28C19C20H6164.5°30.0°
C28C19C20H776.4°150.1°
C28C19C18H19179.1°180.0°
C19C28C29H29179.6°180.0°
C17C16C29C280.3°0.6°
C17C16C29C15179.4°179.9°
C17C16C15N1423.6°90.0°
C17C16C15H397.1°29.9°
C17C16C15H4144.3°150.0°
C16C17C18H19179.2°179.9°
C17C16C29H29179.7°179.9°
C28C29C16H29180.0°179.5°
C28C29C16C15179.1°179.5°
C29C16C15N14157.0°90.1°
C29C16C15H382.3°150.0°
C29C16C15H436.3°29.9°
C29C16C17H5179.5°180.0°
C16C29C28H12179.6°180.0°
C16C15N14C1394.9°95.0°
C16C15N14H3120.7°120.0°
C16C15N14H4120.7°120.0°
C16C15N14C0884.9°85.0°
C16C15H3H4118.0°120.0°
C15C16C17H51.1°0.1°
C15C16C29H290.9°0.0°
C12C13N14H2180.0°179.9°
C13C12C09H18180.0°180.0°
C12C13N14C15180.0°180.0°
C12C13N14C080.2°0.0°
C13C12C09C080.0°0.0°
C13C12C09C10179.6°180.0°
N14C13C12C090.2°0.0°
C13N14C15C08179.8°180.0°
C13N14C08C090.2°0.0°
C13N14C08C07179.8°179.4°
C13N14C15H325.8°25.0°
C13N14C15H4144.4°145.0°
N14C13C12H18179.8°180.0°
C12C09C08N140.1°0.0°
C12C09C08C10179.6°180.0°
C12C09C08C07179.7°179.5°
C12C09C10C11179.4°180.0°
C12C09C10H10.6°0.3°
C09C12C13H2179.8°179.9°
C15N14C08C09180.0°180.0°
C15N14C08C070.4°0.7°
C15N14C13H20.1°0.1°
N14C15H3H4118.0°120.0°
N14C08C09C07179.6°179.5°
N14C08C09C10179.5°180.0°
N14C08C07C06177.4°180.0°
C08N14C13H2179.7°179.9°
C08N14C15H3154.4°155.0°
C08N14C15H435.8°35.0°
N14C08C07H162.5°0.5°
C08C09C10C110.1°0.0°
C09C08C07C062.1°0.7°
C08C09C10H1179.9°179.7°
C09C08C07H16178.0°179.8°
C08C09C12H18180.0°180.0°
C10C09C08C070.1°0.5°
C09C10C11H1180.0°179.7°
C09C10C11C061.6°0.3°
C09C10C11H17178.4°179.8°
C10C09C12H180.5°0.0°
C08C07C06H16180.0°179.5°
C08C07C06C113.8°0.5°
C08C07C06C05175.2°179.5°
C10C11C06C073.5°0.1°
C10C11C06H17180.0°179.9°
C10C11C06C05174.5°180.0°
C07C06C11C05170.9°180.0°
C07C06C05N040.6°35.1°
C07C06C05C30168.9°145.3°
C07C06C11H17176.5°180.0°
C11C06C05N04171.8°145.0°
C11C06C05C302.3°34.7°
C06C11C10H1178.4°180.0°
C11C06C07H16176.2°179.9°
C06C05N04C30171.5°179.7°
C06C05N04N03175.0°180.0°
C06C05C30C318.9°0.2°
C06C05C30C02173.9°179.9°
C05C06C07H164.8°0.0°
C05C06C11H175.6°0.0°
N04C05C30C31179.7°180.0°
N04C05C30C023.0°0.4°
C05N04N03C022.6°0.0°
C05N04N03H15177.4°180.0°
N03N04C05C303.5°0.2°
N04N03C02C300.6°0.3°
N04N03C02H15180.0°180.0°
N04N03C02N01179.6°180.0°
C05C30C31C02176.9°179.6°
C05C30C02N031.5°0.4°
C05C30C31N32177.2°132.6°
C05C30C02N01177.5°179.9°
C31C30C02N03179.0°180.0°
C31C30C02N010.0°0.2°
C30C02N03N01179.0°179.7°
C02C30C31N320.3°47.0°
C30C02N01H13180.0°179.7°
C30C02N01H1460.0°0.3°
C30C02N03H15179.4°179.7°
N03C02N01H131.2°0.0°
N03C02N01H14121.2°180.0°
C02N01H13H14120.0°180.0°
N01C02N03H150.4°0.0°
H1C10C11H171.6°0.0°
H2C13C12H180.2°0.1°
H5C17C18H190.7°0.3°
H8C22C23H21167.9°58.4°
H8C22C23H2249.3°178.4°
H9C22C23H2148.8°61.6°
H9C22C23H2269.8°58.4°
H10C26C27H27164.0°58.3°
H10C26C27H2845.0°61.7°
H11C26C27H2745.7°178.5°
H11C26C27H2873.4°58.4°
H12C28C29H290.4°0.5°
H24C25H25H26120.0°120.0°

222624

PDB entries from 2024-07-17

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