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NN7

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2sing1.53Å1.53Å
C2C4sing1.53Å1.54Å
C2N22sing1.47Å1.47Å
C4N5sing1.46Å1.47Å
N5C6sing1.39Å1.41Å
C6C7sing1.38Å1.40ÅAromatic
C6C14doub1.41Å1.41ÅAromatic
C7C8doub1.39Å1.39ÅAromatic
C8C9sing1.38Å1.38ÅAromatic
C9C10doub1.39Å1.41ÅAromatic
C10N11sing1.37Å1.37ÅAromatic
C10C14sing1.41Å1.42ÅAromatic
N11N12sing1.40Å1.40ÅAromatic
N11C15sing1.40Å1.41Å
N12C13doub1.30Å1.30ÅAromatic
C13C14sing1.42Å1.41ÅAromatic
C15C16sing1.39Å1.41ÅAromatic
C15C21doub1.39Å1.40ÅAromatic
C16C17doub1.38Å1.39ÅAromatic
C17C18sing1.39Å1.40ÅAromatic
C18F19sing1.35Å1.35Å
C18C20doub1.38Å1.39ÅAromatic
C20C21sing1.38Å1.39ÅAromatic
N22S23sing1.66Å1.66Å
S23O24doub1.42Å1.44Å
S23O25doub1.42Å1.43Å
S23C26sing1.76Å1.79Å
C26C27sing1.38Å1.41ÅAromatic
C26C33doub1.38Å1.41ÅAromatic
C27C28sing1.51Å1.50Å
C27C29doub1.38Å1.39ÅAromatic
C29C30sing1.38Å1.38ÅAromatic
C30C31sing1.51Å1.51Å
C30C32doub1.38Å1.39ÅAromatic
C32C33sing1.38Å1.39ÅAromatic
C33C34sing1.51Å1.51Å
C1H11Csing1.09Å1.10Å
C1H12Csing1.09Å1.10Å
C1H13Csing1.09Å1.10Å
C2H2sing1.09Å1.10Å
C4H41Csing1.09Å1.10Å
C4H42Csing1.09Å1.10Å
N22H22sing0.97Å1.00Å
N5H5sing0.97Å1.00Å
C7H7sing1.08Å1.08Å
C8H8sing1.08Å1.08Å
C9H9sing1.08Å1.08Å
C13H13sing1.08Å1.08Å
C16H16sing1.08Å1.08Å
C21H21sing1.08Å1.08Å
C17H17sing1.08Å1.08Å
C20H20sing1.08Å1.08Å
C28H281sing1.09Å1.10Å
C28H282sing1.09Å1.10Å
C28H283sing1.09Å1.10Å
C29H29sing1.08Å1.08Å
C31H311sing1.09Å1.10Å
C31H312sing1.09Å1.10Å
C31H313sing1.09Å1.10Å
C32H32sing1.08Å1.08Å
C34H341sing1.09Å1.10Å
C34H342sing1.09Å1.10Å
C34H343sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C1C2C4113.4°109.5°
C1C2N22107.3°109.4°
C2C1H11C109.5°109.5°
C2C1H12C109.5°109.5°
C2C1H13C109.5°109.5°
C1C2H2108.8°109.5°
C4C2N22108.9°109.5°
C2C4N5114.4°109.5°
C4C2H2108.7°109.5°
C2C4H41C108.3°109.5°
C2C4H42C108.2°109.5°
C2N22S23121.1°120.0°
N22C2H2109.7°109.5°
C2N22H22106.5°119.9°
C4N5C6125.1°120.0°
N5C4H41C108.2°109.5°
N5C4H42C108.2°109.5°
C4N5H5105.5°120.0°
N5C6C7124.3°120.2°
N5C6C14117.9°120.2°
C6N5H5105.4°120.0°
C7C6C14117.9°119.6°
C6C7C8121.8°120.5°
C6C7H7119.1°119.8°
C6C14C10119.9°119.5°
C6C14C13132.3°133.6°
C7C8C9120.9°120.7°
C8C7H7119.1°119.8°
C7C8H8119.6°119.6°
C8C9C10118.9°120.0°
C9C8H8119.6°119.7°
C8C9H9120.6°120.0°
C9C10N11133.7°133.7°
C9C10C14120.6°119.8°
C10C9H9120.6°120.0°
N11C10C14105.7°106.5°
C10N11N12108.1°108.1°
C10N11C15127.1°126.0°
C10C14C13107.7°106.9°
N12N11C15124.8°125.9°
N11N12C13110.6°109.8°
N11C15C16121.0°120.1°
N11C15C21118.4°120.0°
N12C13C14107.8°108.7°
N12C13H13126.1°125.7°
C14C13H13126.1°125.6°
C16C15C21120.5°119.9°
C15C16C17118.5°119.9°
C15C16H16120.7°120.0°
C15C21C20120.9°119.9°
C15C21H21119.5°120.0°
C16C17C18120.5°120.0°
C17C16H16120.8°120.0°
C16C17H17119.7°120.0°
C17C18F19119.1°119.9°
C17C18C20121.3°120.1°
C18C17H17119.8°120.0°
F19C18C20119.6°120.0°
C18C20C21118.2°120.1°
C18C20H20120.9°119.9°
C20C21H21119.5°120.0°
C21C20H20120.9°120.0°
N22S23O24105.8°106.4°
N22S23O25103.4°106.4°
N22S23C26109.5°107.2°
S23N22H22106.5°120.0°
O24S23O25120.8°123.2°
O24S23C26107.8°106.4°
O25S23C26109.1°106.4°
S23C26C27120.7°120.0°
S23C26C33121.9°120.0°
C27C26C33117.4°120.0°
C26C27C28123.9°120.0°
C26C27C29121.5°120.0°
C26C33C32120.3°120.0°
C26C33C34124.0°120.0°
C28C27C29114.7°120.0°
C27C28H281109.5°109.5°
C27C28H282109.5°109.4°
C27C28H283109.4°109.5°
C27C29C30120.3°120.0°
C27C29H29119.8°120.0°
C29C30C31119.8°120.0°
C29C30C32119.1°120.0°
C30C29H29119.8°120.0°
C31C30C32121.1°120.0°
C30C31H311109.5°109.5°
C30C31H312109.5°109.5°
C30C31H313109.5°109.5°
C30C32C33121.4°120.0°
C30C32H32119.3°120.0°
C32C33C34115.6°120.1°
C33C32H32119.3°120.0°
C33C34H341109.5°109.5°
C33C34H342109.5°109.5°
C33C34H343109.5°109.5°
H11CC1H12C109.4°109.5°
H11CC1H13C109.5°109.5°
H12CC1H13C109.5°109.5°
H41CC4H42C109.5°109.5°
H281C28H282109.4°109.5°
H281C28H283109.5°109.5°
H282C28H283109.5°109.4°
H311C31H312109.5°109.4°
H311C31H313109.4°109.4°
H312C31H313109.5°109.4°
H341C34H342109.5°109.5°
H341C34H343109.5°109.5°
H342C34H343109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C1C2C4N22119.4°120.0°
C1C2C4H2121.2°120.0°
C1C2N22H2118.1°119.9°
C1C2C4N547.6°175.0°
C1C2N22S23141.8°95.0°
C2C1H11CH12C120.0°120.0°
C2C1H11CH13C120.0°120.0°
C2C1H12CH13C120.0°120.0°
C1C2C4H41C73.1°65.0°
C1C2C4H42C168.3°55.0°
C1C2N22H2296.6°85.0°
C4C2N22H2118.8°120.0°
C2C4N5H41C120.8°120.0°
C2C4N5H42C120.7°120.0°
C2C4N5C678.8°180.0°
C4C2N22S2395.1°145.0°
C4C2C1H11C180.0°60.0°
C4C2C1H12C60.0°60.0°
C4C2C1H13C60.0°180.0°
C2C4H41CH42C117.8°120.0°
C4C2N22H2226.5°35.0°
C2C4N5H543.3°0.0°
N22C2C4N5167.0°55.0°
C2N22S23H22121.6°180.0°
C2N22S23O24176.4°178.5°
C2N22S23O2555.7°48.6°
C2N22S23C2660.5°65.0°
N22C2C1H11C59.8°60.0°
N22C2C1H12C60.2°180.0°
N22C2C1H13C179.8°60.0°
N22C2C4H41C46.2°175.0°
N22C2C4H42C72.3°65.0°
C4N5C6H5122.1°179.9°
C4N5C6C719.1°0.1°
C4N5C6C14162.1°179.7°
N5C4C2H273.5°65.0°
N5C4H41CH42C117.7°120.0°
N5C6C7C14178.8°179.6°
N5C6C7C8177.1°179.9°
N5C6C14C10178.3°179.8°
N5C6C14C132.0°0.7°
C6N5C4H41C160.5°59.9°
C6N5C4H42C41.9°60.1°
N5C6C7H72.9°0.1°
C6C7C8H7180.0°180.0°
C6C7C8C92.3°0.0°
C7C6C14C100.6°0.5°
C7C6C14C13179.1°179.6°
C7C6N5H5103.0°180.0°
C6C7C8H8177.7°179.9°
C14C6C7C81.7°0.3°
C6C14C10C90.0°0.5°
C6C14C10N11179.8°179.6°
C6C14C10C13179.8°179.3°
C6C14C13N12179.9°179.5°
C14C6N5H575.8°0.3°
C14C6C7H7178.2°179.7°
C6C14C13H130.1°0.7°
C7C8C9H8180.0°179.9°
C7C8C9C101.6°0.0°
C7C8C9H9178.4°180.0°
C8C9C10H9180.0°180.0°
C8C9C10N11179.7°180.0°
C8C9C10C140.5°0.2°
C9C8C7H7177.7°180.0°
C9C10N11C14179.9°179.8°
C9C10N11N12179.9°180.0°
C9C10N11C150.9°0.1°
C9C10C14C13179.8°179.8°
C10C9C8H8178.4°179.9°
C10N11N12C15179.1°180.0°
C10N11N12C130.4°0.0°
N11C10C14C130.1°0.3°
C10N11C15C1659.9°145.0°
C10N11C15C21123.4°35.3°
N11C10C9H90.3°0.0°
C14C10N11N120.2°0.2°
C14C10N11C15178.9°179.8°
C10C14C13N120.3°0.3°
C14C10C9H9179.5°179.8°
C10C14C13H13179.7°179.9°
N11N12C13C140.5°0.2°
N12N11C15C16121.1°35.0°
N12N11C15C2155.5°144.7°
N11N12C13H13179.6°180.0°
C15N11N12C13178.7°180.0°
N11C15C16C21176.6°179.7°
N11C15C16C17179.5°180.0°
N11C15C21C20177.3°179.7°
N11C15C16H160.5°0.0°
N11C15C21H212.7°0.0°
N12C13C14H13180.0°179.8°
C15C16C17H16180.0°179.9°
C15C16C17C183.2°0.1°
C16C15C21C200.6°0.6°
C16C15C21H21179.3°179.7°
C15C16C17H17176.8°180.0°
C21C15C16C172.9°0.2°
C15C21C20C181.3°0.6°
C15C21C20H21180.0°179.7°
C21C15C16H16177.1°179.7°
C15C21C20H20178.7°179.7°
C16C17C18H17180.0°179.9°
C16C17C18F19179.0°180.0°
C16C17C18C201.3°0.1°
C17C18F19C20177.7°180.0°
C17C18C20C211.0°0.3°
C18C17C16H16176.8°180.0°
C17C18C20H20179.1°180.0°
F19C18C20C21176.7°179.7°
F19C18C17H171.0°0.0°
F19C18C20H203.3°0.1°
C18C20C21H20180.0°179.8°
C18C20C21H21178.7°179.7°
C20C18C17H17178.7°180.0°
N22S23O24O25116.7°122.9°
N22S23O24C26117.1°114.1°
N22S23O25C26116.5°114.1°
N22S23C26C2763.4°96.4°
N22S23C26C33115.3°83.3°
S23N22C2H223.7°24.9°
O24S23O25C26125.6°122.9°
O24S23C26C2751.2°150.0°
O24S23C26C33130.0°30.2°
O24S23N22H2254.8°1.5°
O25S23C26C27175.9°17.1°
O25S23C26C332.8°163.1°
O25S23N22H22177.3°131.4°
S23C26C27C33178.8°179.8°
S23C26C27C281.9°0.1°
S23C26C27C29177.9°180.0°
S23C26C33C32177.7°179.8°
S23C26C33C342.8°0.0°
C26S23N22H2261.1°115.0°
C26C27C28C29179.8°179.9°
C26C27C29C300.7°0.0°
C27C26C33C321.0°0.5°
C27C26C33C34176.0°179.7°
C26C27C28H28190.1°72.3°
C26C27C28H282149.9°167.7°
C26C27C28H28329.9°47.8°
C26C27C29H29179.3°180.0°
C33C26C27C28179.4°179.7°
C33C26C27C290.9°0.2°
C26C33C32C300.3°0.4°
C26C33C32C34175.3°179.8°
C26C33C32H32179.6°179.7°
C26C33C34H34187.2°84.3°
C26C33C34H342152.8°155.8°
C26C33C34H34332.8°35.8°
C28C27C29C30179.1°180.0°
C27C28H281H282120.0°120.0°
C27C28H281H283120.0°120.0°
C27C28H282H283120.0°120.0°
C28C27C29H290.9°0.1°
C27C29C30H29180.0°180.0°
C27C29C30C31179.1°180.0°
C27C29C30C322.1°0.1°
C29C27C28H28190.1°107.7°
C29C27C28H28229.9°12.4°
C29C27C28H283149.9°132.3°
C29C30C31C32177.0°179.9°
C29C30C32C331.9°0.2°
C29C30C31H31188.5°90.0°
C29C30C31H312151.5°150.0°
C29C30C31H31331.5°30.0°
C29C30C32H32178.1°180.0°
C31C30C32C33178.9°179.8°
C31C30C29H290.9°0.0°
C30C31H311H312120.0°120.1°
C30C31H311H313120.0°120.0°
C30C31H312H313120.0°120.0°
C31C30C32H321.1°0.1°
C30C32C33H32180.0°179.9°
C30C32C33C34175.0°179.8°
C32C30C29H29177.9°180.0°
C32C30C31H31188.5°90.0°
C32C30C31H31231.6°30.1°
C32C30C31H313151.6°150.0°
C32C33C34H34188.0°95.5°
C32C33C34H34232.0°24.5°
C32C33C34H343152.0°144.5°
C34C33C32H325.0°0.1°
C33C34H341H342120.0°120.0°
C33C34H341H343120.0°120.0°
C33C34H342H343120.0°120.0°
H11CC1H12CH13C120.0°120.0°
H11CC1C2H258.9°179.9°
H12CC1C2H2178.9°60.0°
H13CC1C2H261.1°60.0°
H2C2C4H41C165.7°55.0°
H2C2C4H42C47.2°175.0°
H2C2N22H22145.3°155.0°
H41CC4N5H577.4°120.0°
H42CC4N5H5164.0°120.0°
H7C7C8H82.3°0.1°
H8C8C9H91.6°0.0°
H16C16C17H173.2°0.0°
H21C21C20H201.3°0.1°
H281C28H282H283120.0°120.0°
H311C31H312H313120.0°119.9°
H341C34H342H343120.0°120.0°

223532

PDB entries from 2024-08-07

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