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U16

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O31C25doub1.21Å1.22Å
C25C23sing1.51Å1.50Å
C25N32sing1.35Å1.32Å
C23C11sing1.53Å1.55Å
C23O27sing1.43Å1.45Å
C23H23sing1.09Å1.10Å
C11C7sing1.51Å1.50Å
C11N24sing1.47Å1.47Å
C11H11sing1.09Å1.10Å
C7C3sing1.38Å1.39ÅAromatic
C7C4doub1.38Å1.41ÅAromatic
C3C6doub1.38Å1.39ÅAromatic
C3H3sing1.08Å1.08Å
C6C5sing1.38Å1.39ÅAromatic
C6H6sing1.08Å1.08Å
C5C9sing1.51Å1.47Å
C5C2doub1.38Å1.38ÅAromatic
C9C14sing1.53Å1.52Å
C9C15sing1.53Å1.50Å
C9H9sing1.09Å1.10Å
C14H141sing1.09Å1.10Å
C14H142sing1.09Å1.10Å
C14H143sing1.09Å1.10Å
C15H151sing1.09Å1.10Å
C15H152sing1.09Å1.10Å
C15H153sing1.09Å1.10Å
C2C4sing1.38Å1.39ÅAromatic
C2H2sing1.08Å1.08Å
C4H4sing1.08Å1.08Å
N24H241sing1.01Å1.00Å
N24H242sing1.01Å1.00Å
O27HO27sing0.97Å0.95Å
N32C33sing1.46Å1.46Å
N32HN32sing0.97Å1.00Å
C33C37sing1.53Å1.52Å
C33C36sing1.51Å1.49Å
C33H33sing1.09Å1.10Å
C37H371sing1.09Å1.10Å
C37H372sing1.09Å1.10Å
C37H373sing1.09Å1.10Å
C36O41doub1.21Å1.21Å
C36N42sing1.35Å1.33Å
N42C43sing1.47Å1.43Å
N42HN42sing0.97Å1.00Å
C43C45sing1.53Å1.52Å
C43C47sing1.51Å1.49Å
C43H43sing1.09Å1.10Å
C45C49sing1.53Å1.53Å
C45H451sing1.09Å1.10Å
C45H452sing1.09Å1.10Å
C49C52sing1.53Å1.53Å
C49C53sing1.53Å1.53Å
C49H49sing1.09Å1.10Å
C52H521sing1.09Å1.10Å
C52H522sing1.09Å1.10Å
C52H523sing1.09Å1.10Å
C53H531sing1.09Å1.10Å
C53H532sing1.09Å1.10Å
C53H533sing1.09Å1.10Å
C47O60doub1.21Å1.23Å
C47O61sing1.34Å1.45Å
O61C62sing1.45Å1.43Å
C62H621sing1.09Å1.10Å
C62H622sing1.09Å1.10Å
C62H623sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O31C25C23118.2°120.0°
O31C25N32124.2°120.0°
C23C25N32117.6°120.0°
C25C23C11107.2°109.5°
C25C23O27106.8°109.5°
C25C23H23113.1°109.5°
C25N32C33122.2°120.0°
C25N32HN32118.9°119.9°
C11C23O27110.9°109.5°
C11C23H23109.2°109.5°
C23C11C7109.4°109.5°
C23C11N24109.5°109.5°
C23C11H11112.5°109.5°
O27C23H23109.6°109.4°
C23O27HO27109.5°106.8°
C7C11N24117.1°109.4°
C7C11H11104.2°109.5°
C11C7C3120.3°120.0°
C11C7C4120.8°120.0°
N24C11H11104.0°109.5°
C11N24H241109.5°106.8°
C11N24H242109.5°106.7°
C3C7C4118.8°120.0°
C7C3C6120.1°120.0°
C7C3H3120.0°120.0°
C7C4C2121.2°120.0°
C7C4H4119.4°120.0°
C6C3H3120.0°120.0°
C3C6C5120.2°120.0°
C3C6H6119.9°120.0°
C5C6H6119.9°120.0°
C6C5C9121.4°120.0°
C6C5C2121.3°120.0°
C9C5C2117.3°120.0°
C5C9C14108.1°109.5°
C5C9C15112.6°109.5°
C5C9H9108.0°109.4°
C5C2C4118.4°120.0°
C5C2H2120.8°120.0°
C14C9C15108.2°109.5°
C14C9H9112.3°109.5°
C9C14H141109.5°109.4°
C9C14H142109.5°109.4°
C9C14H143109.5°109.5°
C15C9H9107.8°109.5°
C9C15H151109.5°109.4°
C9C15H152109.5°109.5°
C9C15H153109.5°109.4°
H141C14H142109.5°109.5°
H141C14H143109.4°109.5°
H142C14H143109.5°109.5°
H151C15H152109.5°109.5°
H151C15H153109.4°109.5°
H152C15H153109.5°109.5°
C4C2H2120.8°120.0°
C2C4H4119.4°120.0°
H241N24H242109.4°106.7°
C33N32HN32118.9°120.0°
N32C33C37110.9°109.5°
N32C33C36110.7°109.5°
N32C33H33107.3°109.5°
C37C33C36108.5°109.5°
C37C33H33109.7°109.5°
C33C37H371109.5°109.5°
C33C37H372109.5°109.5°
C33C37H373109.5°109.5°
C36C33H33109.8°109.5°
C33C36O41121.5°120.0°
C33C36N42116.8°120.0°
H371C37H372109.4°109.5°
H371C37H373109.5°109.4°
H372C37H373109.5°109.5°
O41C36N42121.7°120.0°
C36N42C43122.6°120.0°
C36N42HN42118.7°120.0°
C43N42HN42118.7°120.0°
N42C43C45120.4°109.5°
N42C43C47110.4°109.5°
N42C43H43111.1°109.4°
C45C43C47124.3°109.5°
C45C43H4380.0°109.5°
C43C45C49114.2°109.5°
C43C45H451107.9°109.5°
C43C45H452106.9°109.5°
C47C43H43102.5°109.4°
C43C47O60119.8°120.0°
C43C47O61120.7°120.0°
C49C45H451107.9°109.5°
C49C45H452106.9°109.4°
C45C49C52111.7°109.4°
C45C49C53114.5°109.5°
C45C49H49104.4°109.5°
H451C45H452113.2°109.4°
C52C49C53109.8°109.5°
C52C49H49109.5°109.5°
C49C52H521109.5°109.5°
C49C52H522109.5°109.4°
C49C52H523109.5°109.5°
C53C49H49106.5°109.5°
C49C53H531109.5°109.5°
C49C53H532109.5°109.4°
C49C53H533109.4°109.5°
H521C52H522109.5°109.5°
H521C52H523109.4°109.5°
H522C52H523109.5°109.5°
H531C53H532109.4°109.4°
H531C53H533109.5°109.5°
H532C53H533109.5°109.5°
O60C47O61119.5°120.0°
C47O61C62120.2°120.0°
O61C62H621109.5°109.4°
O61C62H622109.5°109.5°
O61C62H623109.4°109.5°
H621C62H622109.4°109.4°
H621C62H623109.5°109.5°
H622C62H623109.5°109.6°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O31C25C23N32178.2°179.9°
O31C25C23C1175.2°115.0°
O31C25C23O2743.8°5.1°
O31C25C23H23164.4°125.0°
O31C25N32C330.3°0.0°
O31C25N32HN32179.7°180.0°
C25C23C11O27116.2°120.0°
C25C23C11H23122.9°120.0°
C25C23O27H23122.9°120.0°
C25C23C11C769.1°175.0°
C25C23C11N24161.4°55.0°
C25C23C11H1146.2°65.0°
C25C23O27HO2721.5°60.1°
C23C25N32C33177.8°180.0°
C23C25N32HN322.2°0.0°
N32C25C23C11103.0°65.0°
N32C25C23O27138.0°175.0°
N32C25C23H2317.4°55.0°
C25N32C33HN32180.0°180.0°
C25N32C33C3782.9°85.0°
C25N32C33C36156.7°155.0°
C25N32C33H3336.9°35.0°
C11C23O27H23120.6°120.0°
C23C11C7N24125.2°120.0°
C23C11C7H11120.5°120.0°
C23C11N24H11120.5°120.0°
C23C11C7C375.4°79.7°
C23C11C7C4101.4°100.0°
C23C11N24H24152.3°173.8°
C23C11N24H24267.7°60.0°
C11C23O27HO2795.0°60.0°
O27C23C11C7174.7°55.0°
O27C23C11N2445.2°65.0°
O27C23C11H1170.0°175.0°
H23C23C11C753.8°65.0°
H23C23C11N2475.7°175.0°
H23C23C11H11169.1°55.0°
H23C23O27HO27144.4°179.9°
C7C11N24H11114.3°120.0°
C11C7C3C4176.8°179.7°
C11C7C3C6179.0°179.8°
C11C7C3H31.0°0.3°
C11C7C4C2179.3°180.0°
C11C7C4H40.7°0.1°
C7C11N24H24172.9°53.7°
C7C11N24H242167.1°60.0°
N24C11C7C349.9°40.3°
N24C11C7C4133.4°140.0°
C11N24H241H242120.0°113.8°
H11C11C7C3164.1°160.3°
H11C11C7C419.2°20.0°
H11C11N24H241172.8°66.2°
H11C11N24H24252.8°180.0°
C7C3C6H3180.0°179.5°
C7C3C6C51.4°0.5°
C7C3C6H6178.6°179.7°
C3C7C4C22.5°0.3°
C3C7C4H4177.5°179.7°
C4C7C3C62.2°0.5°
C4C7C3H3177.8°180.0°
C7C4C2C51.9°0.0°
C7C4C2H4180.0°180.0°
C7C4C2H2178.0°180.0°
C3C6C5H6180.0°179.8°
C3C6C5C9179.3°179.8°
C3C6C5C20.8°0.2°
H3C3C6C5178.6°180.0°
H3C3C6H61.4°0.2°
C6C5C9C2178.6°180.0°
C6C5C9C14104.5°60.0°
C6C5C9C1514.9°60.0°
C6C5C9H9133.8°180.0°
C6C5C2C41.1°0.0°
C6C5C2H2178.9°180.0°
H6C6C5C90.7°0.0°
H6C6C5C2179.2°180.0°
C5C9C14C15122.1°120.0°
C5C9C14H9119.0°119.9°
C5C9C15H9119.0°119.9°
C5C9C14H14193.9°60.0°
C5C9C14H14226.1°60.0°
C5C9C14H143146.1°179.9°
C5C9C15H151102.2°60.0°
C5C9C15H15217.8°179.9°
C5C9C15H153137.8°60.0°
C9C5C2C4179.6°180.0°
C9C5C2H20.4°0.0°
C2C5C9C1474.1°120.0°
C2C5C9C15166.5°120.0°
C2C5C9H947.6°0.0°
C5C2C4H2180.0°179.9°
C5C2C4H4178.1°180.0°
C14C9C15H9121.7°120.0°
C9C14H141H142120.0°120.0°
C9C14H141H143120.0°120.0°
C9C14H142H143120.0°120.0°
C14C9C15H151138.4°180.0°
C14C9C15H152101.5°60.0°
C14C9C15H15318.5°60.0°
C15C9C14H14128.2°180.0°
C15C9C14H142148.2°60.0°
C15C9C14H14391.8°60.0°
C9C15H151H152120.0°120.0°
C9C15H151H153120.0°120.0°
C9C15H152H153120.0°120.0°
H9C9C14H141147.1°60.0°
H9C9C14H14292.9°180.0°
H9C9C14H14327.1°60.0°
H9C9C15H15116.7°60.0°
H9C9C15H152136.8°60.0°
H9C9C15H153103.2°180.0°
H141C14H142H143120.0°120.0°
H151C15H152H153119.9°120.1°
H2C2C4H42.0°0.0°
N32C33C37C36121.7°120.0°
N32C33C37H33118.4°120.0°
N32C33C36H33118.3°120.0°
N32C33C37H371162.1°60.0°
N32C33C37H37242.1°180.0°
N32C33C37H37377.9°60.0°
N32C33C36O4134.9°0.0°
N32C33C36N42146.8°180.0°
HN32N32C33C3797.1°95.0°
HN32N32C33C3623.3°25.0°
HN32N32C33H33143.2°145.0°
C37C33C36H33119.8°120.0°
C33C37H371H372120.0°120.0°
C33C37H371H373120.0°120.0°
C33C37H372H373120.0°120.0°
C37C33C36O4187.0°120.0°
C37C33C36N4291.3°59.9°
C36C33C37H37176.1°60.0°
C36C33C37H372163.9°60.0°
C36C33C37H37343.9°180.0°
C33C36O41N42178.2°180.0°
C33C36N42C43176.4°180.0°
C33C36N42HN423.6°0.0°
H33C33C37H37143.8°NaN°
H33C33C37H37276.2°60.0°
H33C33C37H373163.8°60.0°
H33C33C36O41153.2°120.0°
H33C33C36N4228.5°60.0°
H371C37H372H373120.0°120.0°
O41C36N42C431.9°0.0°
O41C36N42HN42178.1°180.0°
C36N42C43HN42180.0°179.9°
C36N42C43C4566.8°155.0°
C36N42C43C4789.6°84.9°
C36N42C43H43157.4°35.0°
N42C43C45C47152.9°120.0°
N42C43C45H43108.7°120.0°
N42C43C47H43118.4°119.9°
N42C43C45C4982.3°64.8°
N42C43C45H451157.7°175.2°
N42C43C45H45235.6°55.2°
N42C43C47O607.6°0.1°
N42C43C47O61172.2°180.0°
HN42N42C43C45113.2°25.1°
HN42N42C43C4790.4°95.0°
HN42N42C43H4322.6°145.1°
C45C43C47H4386.3°120.0°
C43C45C49H451120.0°120.1°
C43C45C49H452117.9°120.0°
C43C45H451H452118.1°120.0°
C43C45C49C52131.6°65.9°
C43C45C49C535.9°174.1°
C43C45C49H49110.1°54.1°
C45C43C47O60162.8°120.0°
C45C43C47O6117.0°60.0°
C47C43C45C49124.8°175.2°
C47C43C45H4514.8°55.1°
C47C43C45H452117.3°64.8°
C43C47O60O61179.8°180.0°
C43C47O61C62153.6°179.9°
H43C43C45C4926.4°55.2°
H43C43C45H45193.6°64.9°
H43C43C45H452144.3°175.2°
H43C43C47O60110.9°120.0°
H43C43C47O6169.4°60.0°
C49C45H451H452118.1°119.9°
C45C49C52C53128.2°120.0°
C45C49C52H49115.2°120.0°
C45C49C53H49114.8°120.0°
C45C49C52H52163.8°60.0°
C45C49C52H522176.2°180.0°
C45C49C52H52356.2°60.0°
C45C49C53H531130.1°60.4°
C45C49C53H53210.1°179.6°
C45C49C53H533109.9°59.6°
H451C45C49C5211.6°54.2°
H451C45C49C53114.1°65.8°
H451C45C49H49129.9°174.2°
H452C45C49C52110.5°174.1°
H452C45C49C53123.8°54.1°
H452C45C49H497.8°65.9°
C52C49C53H49118.5°120.0°
C49C52H521H522120.0°119.9°
C49C52H521H523120.0°120.1°
C49C52H522H523120.0°120.0°
C52C49C53H531103.2°179.6°
C52C49C53H532136.8°59.7°
C52C49C53H53316.8°60.3°
C53C49C52H521168.0°60.0°
C53C49C52H52248.0°60.0°
C53C49C52H52372.0°180.0°
C49C53H531H532120.0°119.9°
C49C53H531H533120.0°120.0°
C49C53H532H533120.0°120.0°
H49C49C52H52151.4°180.0°
H49C49C52H52268.6°60.0°
H49C49C52H523171.4°59.9°
H49C49C53H53115.3°59.6°
H49C49C53H532104.7°60.3°
H49C49C53H533135.3°179.6°
H521C52H522H523120.0°120.0°
H531C53H532H533120.0°120.0°
O60C47O61C6226.6°0.0°
C47O61C62H62155.7°60.0°
C47O61C62H62264.3°59.9°
C47O61C62H623175.7°180.0°
O61C62H621H622120.0°120.0°
O61C62H621H623120.0°120.0°
O61C62H622H623120.0°120.0°
H621C62H622H623120.0°120.0°

222415

PDB entries from 2024-07-10

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