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QO4

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O29C28doub1.22Å1.21Å
F36C33sing1.40Å1.39Å
N30C28sing1.35Å1.34Å
N30N31sing1.40Å1.40Å
C28C27sing1.40Å1.40Å
N31C32doub1.30Å1.30Å
C27C33sing1.51Å1.49Å
C27C26doub1.38Å1.40Å
C33F35sing1.40Å1.38Å
C33F34sing1.40Å1.37Å
C32C26sing1.41Å1.41Å
C26N25sing1.38Å1.39Å
N25C2sing1.47Å1.49Å
C1C2sing1.53Å1.54Å
C2C3sing1.53Å1.53Å
C3O4sing1.43Å1.41Å
O4C5sing1.43Å1.43Å
F22C21sing1.40Å1.37Å
C19N20doub1.32Å1.34ÅAromatic
C19C18sing1.39Å1.39ÅAromatic
N20C15sing1.32Å1.34ÅAromatic
C10N9sing1.47Å1.48Å
C10C11sing1.53Å1.52Å
C6C5sing1.53Å1.54Å
C6C7sing1.51Å1.52Å
N9C7sing1.35Å1.36Å
N9C14sing1.47Å1.46Å
C11N12sing1.47Å1.46Å
C7O8doub1.21Å1.20Å
C14C13sing1.53Å1.52Å
C18C21sing1.51Å1.51Å
C18C17doub1.39Å1.39ÅAromatic
C15N12sing1.38Å1.40Å
C15N16doub1.32Å1.33ÅAromatic
C21F24sing1.40Å1.39Å
C21F23sing1.40Å1.39Å
N12C13sing1.47Å1.47Å
N16C17sing1.32Å1.33ÅAromatic
C5H1sing1.09Å1.10Å
C5H2sing1.09Å1.10Å
C6H3sing1.09Å1.10Å
C6H4sing1.09Å1.10Å
C10H5sing1.09Å1.10Å
C10H6sing1.09Å1.10Å
C13H7sing1.09Å1.10Å
C13H8sing1.09Å1.10Å
C17H9sing1.08Å1.08Å
C1H10sing1.09Å1.10Å
C1H11sing1.09Å1.10Å
C1H12sing1.09Å1.10Å
C2H13sing1.09Å1.10Å
C3H14sing1.09Å1.10Å
C3H15sing1.09Å1.10Å
C11H16sing1.09Å1.10Å
C11H17sing1.09Å1.10Å
C14H18sing1.09Å1.10Å
C14H19sing1.09Å1.10Å
C19H20sing1.08Å1.08Å
N25H21sing0.97Å1.00Å
N30H22sing0.97Å1.00Å
C32H23sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O29C28N30120.0°120.1°
O29C28C27120.1°120.2°
F36C33C27110.1°109.5°
F36C33F35108.6°109.5°
F36C33F34109.5°109.5°
C28N30N31119.7°120.5°
N30C28C27119.9°119.6°
C28N30H22120.2°119.7°
N30N31C32122.1°121.0°
N31N30H22120.2°119.8°
C28C27C33117.5°120.5°
C28C27C26119.6°119.0°
N31C32C26120.4°120.4°
N31C32H23119.8°119.8°
C33C27C26122.9°120.5°
C27C33F35110.6°109.4°
C27C33F34110.6°109.5°
C27C26C32118.4°119.4°
C27C26N25121.0°120.3°
F35C33F34107.4°109.5°
C32C26N25120.7°120.3°
C26C32H23119.8°119.8°
C26N25C2123.8°120.0°
C26N25H21105.8°120.0°
N25C2C1107.9°109.4°
N25C2C3113.3°109.5°
N25C2H13110.4°109.4°
C2N25H21105.8°120.0°
C1C2C3105.6°109.5°
C2C1H10109.5°109.5°
C2C1H11109.5°109.5°
C2C1H12109.5°109.5°
C1C2H13109.7°109.5°
C2C3O4111.0°109.5°
C3C2H13109.8°109.5°
C2C3H14109.1°109.5°
C2C3H15109.1°109.5°
C3O4C5112.1°114.0°
O4C3H14109.1°109.4°
O4C3H15109.1°109.4°
O4C5C6107.4°109.5°
O4C5H1110.0°109.4°
O4C5H2110.0°109.5°
F22C21C18111.3°109.5°
F22C21F24108.1°109.4°
F22C21F23109.8°109.5°
N20C19C18118.7°119.2°
C19N20C15121.8°120.7°
N20C19H20120.6°120.4°
C19C18C21123.0°120.7°
C19C18C17118.0°118.5°
C18C19H20120.7°120.4°
N20C15N12121.5°119.2°
N20C15N16119.8°121.6°
N9C10C11116.6°108.5°
C10N9C7120.3°120.8°
C10N9C14118.2°118.3°
N9C10H5107.6°109.6°
N9C10H6107.7°109.6°
C10C11N12115.6°109.3°
C11C10H5107.7°109.6°
C11C10H6107.6°109.6°
C10C11H16107.9°109.5°
C10C11H17107.9°109.5°
C5C6C7113.8°109.5°
C6C5H1110.0°109.5°
C6C5H2110.0°109.5°
C5C6H3108.4°109.5°
C5C6H4108.4°109.5°
C6C7N9121.0°120.0°
C6C7O8119.3°120.0°
C7C6H3108.4°109.5°
C7C6H4108.4°109.5°
C7N9C14121.4°120.9°
N9C7O8119.7°120.0°
N9C14C13110.6°108.5°
N9C14H18109.2°109.6°
N9C14H19109.2°109.7°
C11N12C15117.5°111.0°
C11N12C13117.5°111.3°
N12C11H16107.9°109.4°
N12C11H17107.9°109.5°
C14C13N12111.7°109.4°
C14C13H7108.9°109.5°
C14C13H8108.9°109.5°
C13C14H18109.2°109.6°
C13C14H19109.2°109.6°
C21C18C17119.0°120.7°
C18C21F24115.0°109.4°
C18C21F23106.7°109.5°
C18C17N16120.0°119.2°
C18C17H9120.0°120.4°
N12C15N16118.4°119.2°
C15N12C13124.3°111.0°
C15N16C17121.5°120.7°
F24C21F23105.8°109.5°
N12C13H7108.9°109.5°
N12C13H8108.9°109.5°
N16C17H9120.0°120.4°
H1C5H2109.5°109.4°
H3C6H4109.5°109.4°
H5C10H6109.5°109.8°
H7C13H8109.5°109.5°
H10C1H11109.5°109.4°
H10C1H12109.5°109.5°
H11C1H12109.5°109.5°
H14C3H15109.5°109.5°
H16C11H17109.5°109.5°
H18C14H19109.4°109.8°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O29C28N30C27180.0°180.0°
O29C28N30N31179.9°179.7°
O29C28C27C330.4°0.0°
O29C28C27C26179.1°180.0°
O29C28N30H220.1°0.0°
F36C33C27C2862.7°19.4°
F36C33C27F35120.1°120.0°
F36C33C27F34121.1°120.0°
F36C33C27C26116.8°160.6°
F36C33F35F34118.3°120.0°
C28N30N31H22180.0°179.7°
C28N30N31C320.9°0.3°
N30C28C27C33179.6°180.0°
N30C28C27C260.9°0.0°
N31N30C28C270.2°0.3°
N30N31C32C261.2°0.0°
N30N31C32H23178.8°180.0°
C28C27C33C26179.5°180.0°
C28C27C33F3557.3°139.4°
C28C27C33F34176.2°100.6°
C28C27C26C320.7°0.3°
C28C27C26N25179.6°180.0°
C27C28N30H22179.8°180.0°
N31C32C26C270.4°0.2°
N31C32C26H23180.0°180.0°
N31C32C26N25179.3°180.0°
C32N31N30H22179.1°180.0°
C27C33F35F34120.8°120.0°
C33C27C26C32179.9°179.7°
C33C27C26N250.2°0.0°
C26C27C33F35123.2°40.6°
C26C27C33F344.3°79.4°
C27C26C32N25179.7°179.7°
C27C26N25C2163.2°174.6°
C27C26N25H2141.2°5.4°
C27C26C32H23179.6°179.7°
C32C26N25C217.1°5.2°
C32C26N25H21139.1°174.9°
C26N25C2H21122.0°180.0°
C26N25C2C1145.8°85.0°
C26N25C2C397.7°155.0°
C26N25C2H1325.9°35.0°
N25C26C32H230.7°0.0°
N25C2C1C3121.4°120.0°
N25C2C1H13120.4°119.9°
N25C2C3H13123.9°120.0°
N25C2C3O460.4°65.0°
N25C2C1H10180.0°60.0°
N25C2C1H1160.0°180.0°
N25C2C1H1260.0°60.0°
N25C2C3H14179.3°55.0°
N25C2C3H1559.8°175.0°
C1C2C3H13118.2°120.0°
C1C2C3O4178.3°55.0°
C2C1H10H11120.0°120.0°
C2C1H10H12120.0°120.1°
C2C1H11H12120.0°120.0°
C1C2C3H1461.5°174.9°
C1C2C3H1558.1°65.0°
C1C2N25H2123.9°95.0°
C2C3O4H14120.2°120.0°
C2C3O4H15120.2°120.0°
C2C3O4C5176.7°180.0°
C3C2C1H1058.6°60.0°
C3C2C1H11178.6°60.0°
C3C2C1H1261.4°180.0°
C2C3H14H15119.3°120.0°
C3C2N25H21140.3°25.0°
C3O4C5C6159.2°180.0°
C3O4C5H139.5°60.0°
C3O4C5H281.1°59.9°
O4C3C2H1363.5°175.0°
O4C3H14H15119.3°120.0°
O4C5C6H1119.7°120.0°
O4C5C6H2119.7°120.0°
O4C5C6C786.0°180.0°
O4C5H1H2121.0°120.0°
O4C5C6H334.6°60.0°
O4C5C6H4153.4°60.0°
C5O4C3H1463.0°60.0°
C5O4C3H1556.5°60.0°
F22C21C18C1919.6°30.2°
F22C21C18F24123.4°119.9°
F22C21C18F23119.7°120.0°
F22C21C18C17162.4°150.0°
F22C21F24F23117.5°120.0°
N20C19C18H20180.0°180.0°
N20C19C18C21178.6°180.0°
N20C19C18C170.6°0.2°
C19N20C15N12177.5°180.0°
C19N20C15N164.0°0.2°
C18C19N20C151.6°0.0°
C19C18C21C17178.0°179.8°
C19C18C21F24143.0°89.7°
C19C18C21F23100.1°150.3°
C19C18C17N160.4°0.3°
C19C18C17H9179.6°179.8°
N20C15N12C1124.5°124.0°
N20C15N12N16173.6°179.8°
N20C15N12C13164.9°0.2°
N20C15N16C174.2°0.2°
C15N20C19H20178.4°180.0°
N9C10C11H5121.0°119.7°
N9C10C11H6121.0°119.7°
C10N9C7C63.3°180.0°
C10N9C7C14176.6°180.0°
N9C10C11N1224.4°53.8°
C10N9C7O8177.6°0.0°
C10N9C14C1347.3°51.2°
N9C10H5H6116.8°120.5°
N9C10C11H16145.3°173.7°
N9C10C11H1796.5°66.1°
C10N9C14H18167.5°68.5°
C10N9C14H1972.9°170.9°
C11C10N9C7150.5°128.8°
C11C10N9C1432.8°51.2°
C10C11N12H16120.9°120.0°
C10C11N12H17120.9°120.0°
C10C11N12C15154.4°172.7°
C10C11N12C1334.3°63.1°
C11C10H5H6116.8°120.5°
C10C11H16H17117.2°120.1°
C5C6C7H3120.6°120.0°
C5C6C7H4120.7°120.1°
C5C6C7N9174.2°180.0°
C5C6C7O86.6°0.0°
C6C5H1H2121.0°120.0°
C5C6H3H4118.1°120.0°
C6C7N9O8179.1°180.0°
C6C7N9C14179.9°0.0°
C7C6C5H1154.3°60.0°
C7C6C5H233.7°60.0°
C7C6H3H4118.0°120.0°
C7N9C14C13136.0°128.8°
N9C7C6H353.6°60.0°
N9C7C6H465.1°60.0°
C7N9C10H588.5°111.5°
C7N9C10H629.5°9.1°
C7N9C14H1815.8°111.5°
C7N9C14H19103.8°9.1°
C14N9C7O81.0°180.0°
N9C14C13H18120.2°119.7°
N9C14C13H19120.2°119.7°
N9C14C13N1254.3°53.8°
C14N9C10H588.2°68.5°
C14N9C10H6153.8°170.9°
N9C14C13H766.0°173.8°
N9C14C13H8174.6°66.2°
N9C14H18H19119.5°120.5°
C11N12C13C1449.8°63.1°
C11N12C15C13170.6°124.3°
C11N12C15N16149.1°55.7°
N12C11C10H596.6°65.9°
N12C11C10H6145.4°173.5°
C11N12C13H770.6°176.9°
C11N12C13H8170.1°56.9°
N12C11H16H17117.2°120.0°
O8C7C6H3127.3°120.0°
O8C7C6H4114.0°120.0°
C14C13N12C15139.7°172.8°
C14C13N12H7120.3°120.0°
C14C13N12H8120.3°120.0°
C14C13H7H8119.0°120.0°
C13C14H18H19119.5°120.5°
C18C21F24F23117.5°120.0°
C21C18C17N16178.5°180.0°
C21C18C17H91.5°0.1°
C21C18C19H201.4°0.0°
C18C17N16C152.0°0.1°
C17C18C21F2439.0°90.0°
C17C18C21F2377.9°30.0°
C18C17N16H9180.0°179.9°
C17C18C19H20179.4°179.7°
N12C15N16C17177.9°180.0°
C15N12C13H7100.0°52.8°
C15N12C13H819.3°67.3°
C15N12C11H1633.6°52.8°
C15N12C11H1784.7°67.3°
N16C15N12C1321.5°180.0°
C15N16C17H9178.0°180.0°
N12C13H7H8119.0°120.1°
C13N12C11H16155.2°176.9°
C13N12C11H1786.6°56.9°
N12C13C14H18174.4°65.8°
N12C13C14H1965.9°173.5°
H1C5C6H385.1°60.0°
H1C5C6H433.7°180.0°
H2C5C6H3154.3°180.0°
H2C5C6H487.0°60.0°
H5C10C11H1624.3°54.0°
H5C10C11H17142.5°174.2°
H6C10C11H1693.7°66.5°
H6C10C11H1724.5°53.6°
H7C13C14H1854.1°54.1°
H7C13C14H19173.8°66.5°
H8C13C14H1865.3°174.1°
H8C13C14H1954.4°53.5°
H10C1H11H12120.0°120.0°
H10C1C2H1359.6°180.0°
H11C1C2H1360.4°60.1°
H12C1C2H13179.6°59.9°
H13C2C3H1456.7°65.0°
H13C2C3H15176.3°55.0°
H13C2N25H2196.1°145.1°

223532

PDB entries from 2024-08-07

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