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WFA

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N06C05sing1.39Å1.36Å
C05N04doub1.32Å1.34ÅAromatic
C05N07sing1.32Å1.33ÅAromatic
N04C03sing1.33Å1.35ÅAromatic
N07C08doub1.33Å1.34ÅAromatic
C03C02sing1.51Å1.51Å
C03C10doub1.38Å1.36ÅAromatic
C08C10sing1.40Å1.42ÅAromatic
C08N09sing1.39Å1.35Å
C01C02sing1.53Å1.54Å
C10O11sing1.36Å1.37Å
O11C12sing1.43Å1.46Å
C26C27sing1.53Å1.53Å
C26C25sing1.53Å1.53Å
C12C13sing1.53Å1.53Å
O30C28doub1.21Å1.24Å
C27N22sing1.47Å1.46Å
C25C28sing1.51Å1.57Å
C25C24sing1.53Å1.53Å
C28O29sing1.34Å1.24Å
C13C14sing1.53Å1.55Å
N22C21sing1.40Å1.42Å
N22C23sing1.47Å1.49Å
N15C14sing1.46Å1.44Å
N15C16sing1.40Å1.39Å
C21C16doub1.39Å1.43ÅAromatic
C21C20sing1.39Å1.38ÅAromatic
C16C17sing1.39Å1.39ÅAromatic
C20C19doub1.38Å1.39ÅAromatic
C17C18doub1.38Å1.39ÅAromatic
C19C18sing1.38Å1.37ÅAromatic
C24C23sing1.53Å1.53Å
C17H1sing1.08Å1.08Å
C18H2sing1.08Å1.08Å
C19H3sing1.08Å1.08Å
C20H4sing1.08Å1.08Å
C26H5sing1.09Å1.10Å
C26H6sing1.09Å1.10Å
C27H7sing1.09Å1.10Å
C27H8sing1.09Å1.10Å
C01H9sing1.09Å1.10Å
C01H10sing1.09Å1.10Å
C01H11sing1.09Å1.10Å
C02H12sing1.09Å1.10Å
C02H13sing1.09Å1.10Å
C12H14sing1.09Å1.10Å
C12H15sing1.09Å1.10Å
C13H16sing1.09Å1.10Å
C13H17sing1.09Å1.10Å
C14H18sing1.09Å1.10Å
C14H19sing1.09Å1.10Å
C23H20sing1.09Å1.10Å
C23H21sing1.09Å1.10Å
C24H22sing1.09Å1.10Å
C24H23sing1.09Å1.10Å
C25H24sing1.09Å1.10Å
N06H25sing0.97Å1.00Å
N06H26sing0.97Å1.00Å
N09H27sing0.97Å1.00Å
N09H28sing0.97Å1.00Å
N15H29sing0.97Å1.00Å
O29H30sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N06C05N04119.0°119.1°
N06C05N07117.7°119.1°
C05N06H25109.5°120.0°
C05N06H26109.5°120.0°
N04C05N07123.3°121.8°
C05N04C03119.9°121.0°
C05N07C08118.3°120.6°
N04C03C02116.5°120.4°
N04C03C10120.0°119.2°
N07C08C10120.4°119.0°
N07C08N09118.1°120.5°
C02C03C10123.4°120.4°
C03C02C01109.6°109.5°
C03C02H12109.4°109.5°
C03C02H13109.5°109.5°
C03C10C08118.0°118.4°
C03C10O11123.4°120.8°
C10C08N09121.4°120.5°
C08C10O11118.5°120.8°
C08N09H27109.5°120.0°
C08N09H28109.5°120.0°
C02C01H9109.5°109.4°
C02C01H10109.5°109.5°
C02C01H11109.5°109.5°
C01C02H12109.4°109.5°
C01C02H13109.4°109.4°
C10O11C12115.8°117.0°
O11C12C13106.5°109.5°
O11C12H14110.2°109.5°
O11C12H15110.2°109.4°
C27C26C25112.1°109.3°
C26C27N22113.0°109.5°
C27C26H5108.8°109.5°
C27C26H6108.8°109.5°
C26C27H7108.6°109.5°
C26C27H8108.6°109.5°
C26C25C28108.9°109.5°
C26C25C24113.3°109.2°
C25C26H5108.8°109.5°
C25C26H6108.8°109.5°
C26C25H24108.4°109.5°
C12C13C14112.5°109.5°
C13C12H14110.2°109.5°
C13C12H15110.2°109.5°
C12C13H16108.7°109.5°
C12C13H17108.7°109.5°
O30C28C25115.0°120.0°
O30C28O29127.3°120.0°
C27N22C21116.1°111.1°
C27N22C23109.8°111.2°
N22C27H7108.6°109.4°
N22C27H8108.6°109.5°
C28C25C24109.9°109.5°
C25C28O29117.7°120.0°
C28C25H24107.8°109.5°
C25C24C23112.5°109.3°
C25C24H22108.7°109.5°
C25C24H23108.7°109.5°
C24C25H24108.4°109.6°
C28O29H30109.5°117.0°
C13C14N15112.5°109.5°
C14C13H16108.7°109.5°
C14C13H17108.7°109.4°
C13C14H18108.7°109.5°
C13C14H19108.7°109.5°
C21N22C23114.5°111.0°
N22C21C16117.3°120.1°
N22C21C20123.2°120.1°
N22C23C24114.4°109.5°
N22C23H20108.2°109.4°
N22C23H21108.2°109.5°
C14N15C16121.4°120.0°
N15C14H18108.7°109.5°
N15C14H19108.7°109.5°
C14N15H29106.4°120.0°
N15C16C21119.0°120.1°
N15C16C17122.8°120.1°
C16N15H29106.4°120.0°
C16C21C20119.5°119.8°
C21C16C17118.2°119.8°
C21C20C19121.4°120.0°
C21C20H4119.3°120.0°
C16C17C18120.7°120.0°
C16C17H1119.7°120.0°
C20C19C18119.4°120.2°
C20C19H3120.3°119.9°
C19C20H4119.3°120.0°
C17C18C19120.8°120.2°
C18C17H1119.6°120.0°
C17C18H2119.6°119.9°
C19C18H2119.6°119.9°
C18C19H3120.3°119.9°
C24C23H20108.2°109.4°
C24C23H21108.2°109.5°
C23C24H22108.7°109.5°
C23C24H23108.7°109.5°
H5C26H6109.5°109.5°
H7C27H8109.5°109.5°
H9C01H10109.5°109.5°
H9C01H11109.5°109.5°
H10C01H11109.5°109.5°
H12C02H13109.5°109.5°
H14C12H15109.5°109.5°
H16C13H17109.5°109.4°
H18C14H19109.4°109.4°
H20C23H21109.5°109.5°
H22C24H23109.5°109.5°
H25N06H26109.5°120.1°
H27N09H28109.5°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N06C05N04N07177.0°180.0°
N06C05N04C03178.2°180.0°
N06C05N07C08178.1°179.8°
C05N06H25H26120.0°180.0°
N04C05N07C081.0°0.3°
C05N04C03C02179.5°180.0°
C05N04C03C101.4°0.2°
N04C05N06H250.0°0.0°
N04C05N06H26120.0°180.0°
N07C05N04C031.1°0.0°
C05N07C08C101.2°0.2°
C05N07C08N09177.9°179.8°
N07C05N06H25177.2°180.0°
N07C05N06H2662.8°0.0°
N04C03C02C10178.1°179.8°
N04C03C10C081.6°0.2°
N04C03C02C0156.4°90.2°
N04C03C10O11179.2°179.8°
N04C03C02H12176.4°149.7°
N04C03C02H1363.7°29.7°
N07C08C10C031.6°0.0°
N07C08C10N09179.1°180.0°
N07C08C10O11179.3°180.0°
N07C08N09H270.0°180.0°
N07C08N09H28120.0°0.0°
C02C03C10C08179.6°180.0°
C03C02C01H12120.0°120.0°
C03C02C01H13120.0°120.0°
C02C03C10O112.8°0.0°
C03C02C01H9180.0°60.0°
C03C02C01H1060.0°60.0°
C03C02C01H1160.0°180.0°
C03C02H12H13120.0°120.0°
C03C10C08O11177.7°180.0°
C03C10C08N09177.5°180.0°
C10C03C02C01121.7°90.0°
C03C10O11C1294.7°90.0°
C10C03C02H121.7°30.0°
C10C03C02H13118.3°150.0°
C08C10O11C1287.8°90.0°
C10C08N09H27179.1°0.0°
C10C08N09H2859.1°180.0°
N09C08C10O110.2°0.0°
C08N09H27H28120.0°180.0°
C02C01H9H10120.0°120.0°
C02C01H9H11120.0°120.0°
C02C01H10H11120.0°120.0°
C01C02H12H13119.9°120.0°
C10O11C12C13176.9°180.0°
C10O11C12H1457.3°60.0°
C10O11C12H1563.6°60.0°
O11C12C13H14119.6°120.1°
O11C12C13H15119.5°119.9°
O11C12C13C1467.3°180.0°
O11C12H14H15121.4°120.0°
O11C12C13H16172.2°60.0°
O11C12C13H1753.2°60.0°
C27C26C25H5120.4°119.9°
C27C26C25H6120.4°120.0°
C26C27N22H7120.5°120.0°
C26C27N22H8120.5°120.0°
C27C26C25C28168.1°177.6°
C27C26C25C2445.4°57.7°
C26C27N22C21169.2°174.2°
C26C27N22C2359.0°61.8°
C27C26H5H6118.8°120.1°
C26C27H7H8118.4°120.0°
C27C26C25H2474.9°62.3°
C26C25C28O308.8°0.0°
C25C26C27N2254.5°59.2°
C26C25C28C24124.7°119.7°
C26C25C28H24117.4°120.1°
C26C25C24H24120.3°120.0°
C26C25C28O29172.0°180.0°
C26C25C24C2342.7°57.7°
C25C26H5H6118.8°120.1°
C25C26C27H7175.0°179.2°
C25C26C27H866.0°60.8°
C26C25C24H22163.2°62.3°
C26C25C24H2377.7°177.6°
C12C13C14H16120.4°120.0°
C12C13C14H17120.5°120.1°
C12C13C14N1560.1°180.0°
C13C12H14H15121.4°120.0°
C12C13H16H17118.6°120.0°
C12C13C14H18179.5°60.0°
C12C13C14H1960.4°60.0°
O30C28C25O29179.2°179.9°
O30C28C25C24133.5°119.7°
O30C28C25H24108.6°120.2°
O30C28O29H300.0°0.1°
C27N22C21C23129.6°124.2°
C27N22C21C1685.0°120.0°
C27N22C21C2094.7°60.0°
C27N22C23C2456.5°61.7°
N22C27C26H5174.9°179.2°
N22C27C26H665.9°60.7°
N22C27H7H8118.4°120.0°
C27N22C23H20177.3°58.2°
C27N22C23H2164.2°178.3°
C28C25C24H24117.6°120.1°
C28C25C24C23164.8°177.6°
C28C25C26H571.5°62.5°
C28C25C26H647.7°57.6°
C28C25C24H2274.7°57.6°
C28C25C24H2344.4°62.4°
C25C28O29H30179.1°179.9°
C24C25C28O2947.3°60.3°
C25C24C23N2248.8°59.2°
C25C24C23H22120.5°120.0°
C25C24C23H23120.5°119.9°
C24C25C26H5165.8°177.6°
C24C25C26H675.0°62.3°
C25C24C23H20169.5°60.8°
C25C24C23H2171.9°179.2°
C25C24H22H23118.6°120.0°
O29C28C25H2470.7°59.9°
C13C14N15H18120.4°120.0°
C13C14N15H19120.5°120.0°
C13C14N15C16177.0°180.0°
C14C13C12H1452.2°60.0°
C14C13C12H15173.2°60.0°
C14C13H16H17118.6°119.9°
C13C14H18H19118.6°120.0°
C13C14N15H2955.3°0.0°
N22C21C16N150.1°0.2°
N22C21C16C20179.7°180.0°
N22C21C16C17180.0°180.0°
N22C21C20C19179.9°180.0°
C21N22C23C24170.8°174.1°
N22C21C20H40.1°0.1°
C21N22C27H748.7°54.2°
C21N22C27H870.3°65.8°
C21N22C23H2050.1°65.9°
C21N22C23H2168.5°54.1°
C23N22C21C16145.4°115.8°
C23N22C21C2034.9°64.2°
N22C23C24H20120.7°119.9°
N22C23C24H21120.7°120.0°
C23N22C27H7179.5°178.3°
C23N22C27H861.6°58.3°
N22C23H20H21117.7°120.0°
N22C23C24H22169.2°60.8°
N22C23C24H2371.7°179.1°
C14N15C16H29121.7°179.9°
C14N15C16C21175.5°179.7°
C14N15C16C174.6°0.0°
N15C14C13H1660.3°60.0°
N15C14C13H17179.4°60.0°
N15C14H18H19118.6°120.0°
N15C16C21C17179.9°179.8°
N15C16C21C20179.6°179.7°
N15C16C17C18179.5°179.7°
N15C16C17H10.5°0.3°
C16N15C14H1862.6°60.0°
C16N15C14H1956.5°60.0°
C16C21C20C190.2°0.0°
C21C16C17C180.4°0.0°
C21C16C17H1179.6°180.0°
C16C21C20H4179.8°179.9°
C21C16N15H2962.8°0.2°
C20C21C16C170.3°0.0°
C21C20C19H4180.0°179.9°
C21C20C19C180.2°0.0°
C21C20C19H3179.8°180.0°
C16C17C18H1180.0°180.0°
C16C17C18C190.3°0.0°
C16C17C18H2179.7°180.0°
C17C16N15H29117.1°180.0°
C20C19C18C170.2°0.0°
C20C19C18H3180.0°180.0°
C20C19C18H2179.8°180.0°
C17C18C19H2180.0°180.0°
C17C18C19H3179.8°180.0°
C19C18C17H1179.7°180.0°
C18C19C20H4179.8°179.9°
C24C23H20H21117.8°120.0°
C23C24H22H23118.6°120.1°
C23C24C25H2477.6°62.3°
H1C17C18H20.3°0.0°
H2C18C19H30.2°0.0°
H3C19C20H40.2°0.1°
H5C26C27H764.6°60.9°
H5C26C27H854.3°59.1°
H5C26C25H2445.5°57.6°
H6C26C27H754.6°59.2°
H6C26C27H8173.6°179.2°
H6C26C25H24164.7°177.7°
H9C01H10H11120.0°120.0°
H9C01C02H1260.0°60.0°
H9C01C02H1360.0°180.0°
H10C01C02H12180.0°180.0°
H10C01C02H1360.1°60.0°
H11C01C02H1260.0°59.9°
H11C01C02H13180.0°60.0°
H14C12C13H1668.2°60.0°
H14C12C13H17172.7°180.0°
H15C12C13H1652.7°180.0°
H15C12C13H1766.4°60.0°
H16C13C14H1860.1°180.0°
H16C13C14H19179.2°60.1°
H17C13C14H1859.0°60.1°
H17C13C14H1960.1°180.0°
H18C14N15H29175.8°120.1°
H19C14N15H2965.2°120.0°
H20C23C24H2270.1°179.3°
H20C23C24H2349.0°59.2°
H21C23C24H2248.5°59.2°
H21C23C24H23167.6°60.9°
H22C24C25H2442.9°177.7°
H23C24C25H24162.0°57.7°

223532

PDB entries from 2024-08-07

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