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ZJK

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O5RU2sing1.80Å2.37Å
C29C25doub1.38Å1.37ÅAromatic
C29C26sing1.38Å1.36ÅAromatic
C25C15sing1.38Å1.40ÅAromatic
O1C8sing1.42Å1.25Å
O1RU2sing1.85Å2.07Å
C26C20doub1.38Å1.39ÅAromatic
C8O2sing1.48Å1.26Å
C15C5doub1.39Å1.39ÅAromatic
C20C5sing1.39Å1.37ÅAromatic
RU2N1sing1.95Å2.04Å
RU2RU1sing2.46Å2.33Å
RU2N4sing1.93Å2.04Å
C5N1sing1.41Å1.43Å
C12C4doub1.38Å1.38ÅAromatic
C12C6sing1.38Å1.37ÅAromatic
C4C1sing1.39Å1.39ÅAromatic
O2RU1sing1.81Å2.09Å
N1C13sing1.46Å1.32Å
C6C17doub1.38Å1.36ÅAromatic
C1N4sing1.41Å1.43Å
C1C11doub1.39Å1.38ÅAromatic
RU1N2sing1.91Å2.04Å
RU1N3sing1.93Å2.05Å
C13N2sing1.50Å1.31Å
N4C16sing1.46Å1.34Å
C17C11sing1.38Å1.38ÅAromatic
N2C9sing1.40Å1.42Å
C23C9doub1.39Å1.38ÅAromatic
C23C27sing1.38Å1.40ÅAromatic
C16N3sing1.49Å1.31Å
C9C21sing1.39Å1.38ÅAromatic
N3C3sing1.40Å1.44Å
C27C30doub1.38Å1.38ÅAromatic
C7C3doub1.39Å1.38ÅAromatic
C7C10sing1.38Å1.38ÅAromatic
C3C2sing1.39Å1.40ÅAromatic
C21C28doub1.38Å1.37ÅAromatic
C30C28sing1.38Å1.36ÅAromatic
C10C14doub1.38Å1.37ÅAromatic
C2C18doub1.38Å1.39ÅAromatic
C14C18sing1.38Å1.37ÅAromatic
C2H1sing1.08Å1.08Å
C4H2sing1.08Å1.08Å
C6H3sing1.08Å1.08Å
C7H4sing1.08Å1.08Å
C8H5sing1.10Å1.10Å
C8H6sing1.10Å1.10Å
C10H7sing1.08Å1.08Å
C11H8sing1.08Å1.08Å
C12H9sing1.08Å1.08Å
C13H10sing1.10Å1.10Å
C13H11sing1.10Å1.10Å
C14H12sing1.08Å1.08Å
C15H13sing1.08Å1.08Å
C16H14sing1.11Å1.10Å
C16H15sing1.11Å1.10Å
C17H16sing1.08Å1.08Å
C18H17sing1.08Å1.08Å
C20H18sing1.08Å1.08Å
C21H19sing1.08Å1.08Å
C23H20sing1.08Å1.08Å
C25H21sing1.08Å1.08Å
C26H22sing1.08Å1.08Å
C27H23sing1.08Å1.08Å
C28H24sing1.08Å1.08Å
C29H25sing1.08Å1.08Å
C30H26sing1.08Å1.08Å
O5H27sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O5RU2O177.7°94.1°
O5RU2N1100.6°93.5°
O5RU2RU1165.7°129.5°
O5RU2N4100.3°143.8°
RU2O5H27109.5°114.0°
C25C29C26117.5°120.1°
C29C25C15120.6°120.1°
C29C25H21119.7°119.9°
C25C29H25121.2°120.0°
C29C26C20122.3°120.1°
C29C26H22118.8°119.9°
C26C29H25121.3°119.9°
C25C15C5122.0°119.9°
C25C15H13119.0°120.0°
C15C25H21119.7°120.0°
C8O1RU2117.0°115.0°
O1C8O2126.5°114.3°
O1C8H5105.1°108.6°
O1C8H6105.1°108.5°
O1RU2N1177.6°146.9°
O1RU2RU190.0°76.0°
O1RU2N490.5°95.5°
C26C20C5121.2°119.9°
C26C20H18119.4°120.0°
C20C26H22118.8°120.0°
C8O2RU1118.5°98.0°
O2C8H5105.1°108.7°
O2C8H6105.1°108.6°
C15C5C20116.3°119.8°
C15C5N1120.2°120.1°
C5C15H13119.0°120.1°
C20C5N1123.5°120.1°
C5C20H18119.4°120.0°
N1RU2RU191.5°74.3°
N1RU2N491.5°97.2°
RU2N1C5124.8°123.8°
RU2N1C13116.0°114.4°
RU1RU2N486.9°86.7°
RU2RU1O287.3°102.5°
RU2RU1N288.3°102.2°
RU2RU1N392.6°98.5°
RU2N4C1118.8°124.3°
RU2N4C16121.3°115.7°
C5N1C13117.8°121.8°
C4C12C6124.7°120.0°
C12C4C1121.0°120.0°
C12C4H2119.5°120.0°
C4C12H9117.6°120.0°
C12C6C17114.3°120.2°
C12C6H3122.8°119.9°
C6C12H9117.7°120.0°
C4C1N4124.6°120.1°
C4C1C11113.4°119.8°
C1C4H2119.5°120.0°
O2RU1N2170.7°118.8°
O2RU1N395.4°115.9°
N1C13N2124.3°117.7°
N1C13H10105.6°107.3°
N1C13H11105.7°107.5°
C6C17C11121.5°120.0°
C17C6H3122.8°119.9°
C6C17H16119.2°120.0°
N4C1C11121.9°120.1°
C1N4C16118.8°120.0°
C1C11C17124.9°120.0°
C1C11H8117.5°120.0°
N2RU1N392.9°114.5°
RU1N2C13119.5°100.6°
RU1N2C9121.1°111.1°
RU1N3C16115.9°102.4°
RU1N3C3126.0°110.8°
C13N2C9119.3°110.8°
N2C13H10105.7°108.2°
N2C13H11105.6°108.4°
N4C16N3122.1°129.5°
N4C16H14106.3°104.8°
N4C16H15106.3°104.5°
C17C11H8117.6°120.0°
C11C17H16119.2°120.0°
N2C9C23125.5°120.1°
N2C9C21117.0°120.1°
C9C23C27119.8°119.9°
C23C9C21117.5°119.9°
C9C23H20120.1°120.0°
C23C27C30122.8°120.1°
C27C23H20120.1°120.1°
C23C27H23118.6°120.0°
C16N3C3115.6°110.1°
N3C16H14106.2°105.8°
N3C16H15106.2°105.5°
C9C21C28121.3°119.9°
C9C21H19119.3°120.1°
N3C3C7118.1°120.1°
N3C3C2125.3°120.0°
C27C30C28115.7°120.1°
C30C27H23118.6°119.9°
C27C30H26122.2°120.0°
C3C7C10122.3°119.9°
C7C3C2116.5°119.9°
C3C7H4118.9°120.0°
C7C10C14121.7°120.1°
C10C7H4118.8°120.1°
C7C10H7119.1°119.9°
C3C2C18119.7°119.9°
C3C2H1120.1°120.1°
C21C28C30122.8°120.1°
C28C21H19119.4°120.0°
C21C28H24118.6°120.0°
C30C28H24118.6°120.0°
C28C30H26122.1°119.9°
C10C14C18116.2°120.1°
C14C10H7119.1°120.0°
C10C14H12121.9°120.0°
C2C18C14123.4°120.1°
C18C2H1120.1°120.0°
C2C18H17118.3°119.9°
C18C14H12121.9°119.9°
C14C18H17118.3°120.0°
H5C8H6109.5°108.0°
H10C13H11109.5°107.3°
H14C16H15109.5°104.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O5RU2O1C8170.7°88.1°
O5RU2O1N144.1°102.8°
O5RU2O1RU1172.7°129.8°
O5RU2O1N4100.4°145.0°
O5RU2N1RU1172.3°130.2°
O5RU2N1N4100.7°145.3°
O5RU2RU1N4120.8°179.8°
O5RU2N1C50.4°100.4°
O5RU2RU1O226.3°71.9°
O5RU2N1C13166.7°79.6°
O5RU2N4C15.5°2.4°
O5RU2RU1N2145.5°51.6°
O5RU2RU1N3121.6°169.1°
O5RU2N4C16162.1°177.5°
C25C29C26H25180.0°179.7°
C29C25C15H21180.0°180.0°
C25C29C26C202.5°0.4°
C29C25C15C50.0°0.0°
C29C25C15H13180.0°180.0°
C25C29C26H22177.5°179.7°
C26C29C25C151.2°0.3°
C29C26C20H22180.0°179.9°
C29C26C20C52.6°0.1°
C29C26C20H18177.4°180.0°
C26C29C25H21178.8°179.7°
C25C15C5H13180.0°180.0°
C25C15C5C200.1°0.3°
C25C15C5N1179.9°180.0°
C15C25C29H25178.8°180.0°
O1C8O2H5122.3°121.4°
O1C8O2H6122.3°121.3°
C8O1RU2N1126.7°14.7°
C8O1RU2RU11.9°41.6°
C8O1RU2N488.8°126.8°
O1C8O2RU18.9°50.4°
O1C8H5H6112.4°117.5°
RU2O1C8O24.1°74.1°
O1RU2N1RU1128.6°27.2°
O1RU2N1N4144.5°111.7°
O1RU2RU1N490.5°96.5°
O1RU2N1C543.3°156.6°
O1RU2RU1O24.0°11.7°
O1RU2N1C13123.0°23.4°
O1RU2N4C183.0°107.0°
O1RU2RU1N2175.8°135.2°
O1RU2RU1N391.3°107.3°
O1RU2N4C1684.5°72.9°
RU2O1C8H5126.4°47.4°
RU2O1C8H6118.2°164.5°
O1RU2O5H27180.0°122.3°
C26C20C5C151.3°0.2°
C26C20C5H18180.0°179.9°
C26C20C5N1178.7°180.0°
C20C26C29H25177.5°179.9°
C8O2RU1RU27.7°16.1°
C8O2RU1N269.6°95.6°
C8O2RU1N384.6°122.0°
O2C8H5H6112.4°117.7°
C15C5C20N1180.0°179.7°
C15C5N1RU2127.6°49.5°
C15C5N1C1338.5°130.5°
C15C5C20H18178.7°179.7°
C5C15C25H21180.0°180.0°
C20C5N1RU252.5°130.7°
C20C5N1C13141.5°49.3°
C20C5C15H13179.9°179.7°
C5C20C26H22177.4°180.0°
N1RU2RU1N491.4°98.4°
RU2N1C5C13166.0°180.0°
N1RU2RU1O2174.1°153.4°
N1RU2N4C195.6°103.7°
N1RU2RU1N22.3°29.8°
N1RU2RU1N390.6°87.6°
RU2N1C13N27.7°65.3°
N1RU2N4C1696.8°76.5°
RU2N1C13H10129.7°172.4°
RU2N1C13H11114.3°57.3°
N1RU2O5H271.7°90.0°
RU1RU2N1C5171.9°129.4°
RU2RU1O2N261.9°111.7°
RU2RU1O2N392.3°105.9°
RU1RU2N1C135.6°50.6°
RU1RU2N4C1173.0°177.4°
RU2RU1N2N392.5°105.3°
RU2RU1N2C130.5°8.4°
RU1RU2N4C165.5°2.7°
RU2RU1N2C9178.2°108.9°
RU2RU1N3C167.2°21.1°
RU2RU1N3C3168.5°138.5°
RU1RU2O5H27148.9°162.6°
N4RU2N1C5101.2°44.9°
RU2N4C1C461.7°2.5°
N4RU2RU1O294.5°108.2°
N4RU2N1C1392.6°135.1°
RU2N4C1C16167.9°179.9°
RU2N4C1C11114.0°177.2°
N4RU2RU1N293.7°128.2°
N4RU2RU1N30.8°10.8°
RU2N4C16N313.0°24.7°
RU2N4C16H14108.8°100.9°
RU2N4C16H15134.7°149.5°
N4RU2O5H2791.8°17.2°
C5N1C13N2175.0°114.7°
C5N1C13H1063.0°7.6°
C5N1C13H1152.9°122.7°
N1C5C15H130.1°0.0°
N1C5C20H181.3°0.0°
C4C12C6H9180.0°180.0°
C12C4C1H2180.0°179.9°
C4C12C6C170.9°0.3°
C12C4C1N4179.1°180.0°
C12C4C1C113.1°0.3°
C4C12C6H3179.1°179.9°
C6C12C4C10.9°0.0°
C12C6C17H3180.0°179.6°
C12C6C17C110.2°0.3°
C6C12C4H2179.1°179.9°
C12C6C17H16179.8°180.0°
C4C1N4C11175.7°179.7°
C4C1N4C16106.2°177.4°
C4C1C11C173.9°0.3°
C4C1C11H8176.1°179.7°
C1C4C12H9179.0°180.0°
O2RU1N2N3154.3°142.9°
O2RU1N2C1361.4°120.2°
O2RU1N2C9116.4°2.9°
O2RU1N3C1680.4°87.2°
O2RU1N3C381.0°30.2°
RU1O2C8H5131.2°71.0°
RU1O2C8H6113.4°171.7°
N1C13N2RU15.3°27.3°
N1C13N2H10122.0°121.7°
N1C13N2H11122.0°122.2°
N1C13N2C9176.9°144.9°
N1C13H10H11113.3°115.3°
C6C17C11C12.3°0.0°
C6C17C11H16180.0°179.7°
C6C17C11H8177.7°180.0°
C17C6C12H9179.2°179.7°
N4C1C11C17180.0°180.0°
C1N4C16N3179.5°155.4°
N4C1C4H20.9°0.1°
N4C1C11H80.0°0.1°
C1N4C16H1458.8°79.0°
C1N4C16H1557.7°30.6°
C11C1N4C1678.1°2.9°
C1C11C17H8180.0°180.0°
C11C1C4H2176.9°179.8°
C1C11C17H16177.7°179.7°
RU1N2C13C9177.8°117.6°
RU1N2C9C23108.4°142.9°
N2RU1N3C1695.6°128.7°
RU1N2C9C2173.6°37.3°
N2RU1N3C3103.0°113.8°
RU1N2C13H10127.3°149.1°
RU1N2C13H11116.7°94.8°
N3RU1N2C1393.0°96.9°
RU1N3C16N413.2°32.5°
N3RU1N2C989.3°145.8°
RU1N3C16C3163.3°117.9°
RU1N3C3C749.0°120.3°
RU1N3C3C2133.2°59.7°
RU1N3C16H14108.5°92.7°
RU1N3C16H15135.0°156.9°
C13N2C9C2369.3°32.0°
C13N2C9C21108.7°148.2°
N2C13H10H11113.3°116.8°
N4C16N3H14121.7°125.2°
N4C16N3H15121.8°124.4°
N4C16N3C3176.6°150.5°
N4C16H14H15114.4°109.6°
C11C17C6H3179.7°179.9°
N2C9C23C21178.0°179.8°
N2C9C23C27178.2°180.0°
N2C9C21C28178.0°180.0°
C9N2C13H1054.9°93.4°
C9N2C13H1161.1°22.8°
N2C9C21H192.0°0.1°
N2C9C23H201.8°0.0°
C9C23C27H20180.0°180.0°
C9C23C27C301.4°0.0°
C23C9C21C280.2°0.2°
C23C9C21H19179.8°179.7°
C9C23C27H23178.6°180.0°
C27C23C9C210.1°0.2°
C23C27C30H23180.0°180.0°
C23C27C30C283.1°0.2°
C23C27C30H26176.9°179.9°
C16N3C3C7112.4°127.1°
C16N3C3C265.5°52.9°
N3C16H14H15114.3°111.1°
C9C21C28H19180.0°179.9°
C9C21C28C302.1°0.1°
C21C9C23H20179.8°179.7°
C9C21C28H24177.9°180.0°
N3C3C7C2178.0°180.0°
N3C3C7C10179.8°180.0°
N3C3C2C18179.5°180.0°
N3C3C2H10.5°0.3°
N3C3C7H40.2°0.0°
C3N3C16H1454.8°25.3°
C3N3C16H1561.7°85.1°
C27C30C28C213.5°0.3°
C27C30C28H26180.0°179.7°
C30C27C23H20178.6°179.9°
C27C30C28H24176.6°179.8°
C3C7C10H4180.0°180.0°
C3C7C10C141.2°0.1°
C7C3C2C182.7°0.0°
C7C3C2H1177.3°179.7°
C3C7C10H7178.8°180.0°
C10C7C3C21.8°0.0°
C7C10C14H7180.0°180.0°
C7C10C14C183.0°0.0°
C7C10C14H12177.0°179.9°
C3C2C18H1180.0°179.7°
C3C2C18C140.8°0.0°
C2C3C7H4178.2°180.0°
C3C2C18H17179.2°179.7°
C21C28C30H24180.0°179.9°
C21C28C30H26176.5°180.0°
C30C28C21H19177.8°180.0°
C28C30C27H23176.9°179.8°
C10C14C18C22.1°0.0°
C10C14C18H12180.0°180.0°
C14C10C7H4178.8°180.0°
C10C14C18H17177.9°179.7°
C2C18C14H17180.0°179.7°
C2C18C14H12177.9°180.0°
C14C18C2H1179.2°179.7°
C18C14C10H7176.9°180.0°
H1C2C18H170.8°0.0°
H2C4C12H91.0°0.1°
H3C6C12H90.9°0.1°
H3C6C17H160.2°0.4°
H4C7C10H71.2°0.0°
H7C10C14H123.0°0.0°
H8C11C17H162.3°0.3°
H12C14C18H172.0°0.3°
H13C15C25H210.0°0.0°
H18C20C26H222.6°0.1°
H19C21C28H242.1°0.1°
H20C23C27H231.4°0.1°
H21C25C29H251.2°0.0°
H22C26C29H252.5°0.0°
H23C27C30H263.1°0.1°
H24C28C30H263.5°0.1°

227344

PDB entries from 2024-11-13

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