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A1IYF

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C02C01sing1.53Å1.53Å
C03C02sing1.53Å1.53Å
N04C03sing1.47Å1.53Å
C06C05sing1.53Å1.51Å
C05N04sing1.47Å1.43Å
C07N04sing1.35Å1.48Å
O08C07doub1.22Å1.25Å
N09C07sing1.35Å1.40Å
C10N09sing1.46Å1.46Å
C11C10sing1.52Å1.57Å
N12C11sing1.47Å1.54Å
C13N12sing1.36Å1.41ÅAromatic
C14C13doub1.37Å1.39ÅAromatic
C16C15doub1.39Å1.37ÅAromatic
C17C16sing1.38Å1.36ÅAromatic
C19C18sing1.38Å1.39ÅAromatic
C20C19doub1.38Å1.33ÅAromatic
C21C19sing1.51Å1.37Å
C18C17doub1.39Å1.36ÅAromatic
F22C17sing1.35Å1.36Å
C15C14sing1.47Å1.47ÅAromatic
C23C14sing1.47Å1.44Å
C24C23doub1.40Å1.36Å
O26C25doub1.21Å1.20Å
N27C25sing1.34Å1.42Å
C28N27sing1.34Å1.40Å
O29C28doub1.22Å1.21Å
C25C24sing1.48Å1.46Å
C30C24sing1.46Å1.46Å
C31C30doub1.39Å1.41ÅAromatic
N32C31sing1.32Å1.41ÅAromatic
C33N32doub1.33Å1.39ÅAromatic
N34C33sing1.37Å1.46ÅAromatic
C35N34sing1.36Å1.42ÅAromatic
C36C35doub1.35Å1.38ÅAromatic
C37C36sing1.40Å1.44ÅAromatic
C38C37doub1.36Å1.37ÅAromatic
C01C06sing1.53Å1.50Å
N09C21sing1.47Å1.43Å
N12C20sing1.39Å1.40ÅAromatic
C15C20sing1.40Å1.40ÅAromatic
C23C28sing1.47Å1.53Å
C30N34sing1.38Å1.44ÅAromatic
C33C38sing1.41Å1.48ÅAromatic
C11H112sing1.09Å1.10Å
C11H111sing1.09Å1.10Å
C01H012sing1.09Å1.10Å
C01H011sing1.09Å1.10Å
C02H021sing1.09Å1.10Å
C02H022sing1.09Å1.10Å
C03H031sing1.09Å1.10Å
C03H032sing1.09Å1.10Å
C05H052sing1.09Å1.10Å
C05H051sing1.09Å1.10Å
C06H061sing1.09Å1.10Å
C06H062sing1.09Å1.10Å
C10H102sing1.09Å1.10Å
C10H101sing1.09Å1.10Å
C13H131sing1.08Å1.08Å
C16H161sing1.08Å1.08Å
C18H181sing1.08Å1.08Å
C21H212sing1.09Å1.10Å
C21H211sing1.09Å1.10Å
C31H311sing1.08Å1.08Å
C35H351sing1.08Å1.08Å
C36H361sing1.08Å1.08Å
C37H371sing1.08Å1.08Å
C38H381sing1.08Å1.08Å
N27H271sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C01C02C03111.8°109.3°
C02C01C06109.9°109.6°
C02C01H012109.4°109.5°
C02C01H011109.4°109.5°
C01C02H021108.9°109.6°
C01C02H022108.9°109.5°
C02C03N04114.8°108.8°
C03C02H021108.9°109.5°
C03C02H022108.9°109.5°
C02C03H031108.1°109.6°
C02C03H032108.1°109.6°
C03N04C05106.6°118.7°
C03N04C07130.0°120.7°
N04C03H031108.1°109.6°
N04C03H032108.1°109.7°
C06C05N04107.6°108.8°
C05C06C01109.8°109.3°
C06C05H052110.0°109.6°
C06C05H051109.9°109.7°
C05C06H061109.4°109.5°
C05C06H062109.4°109.5°
C05N04C07123.0°120.7°
N04C05H052109.9°109.6°
N04C05H051109.9°109.6°
N04C07O08116.1°120.0°
N04C07N09130.9°120.0°
O08C07N09112.9°120.0°
C07N09C10119.3°119.2°
C07N09C21125.4°119.3°
N09C10C11115.2°112.9°
C10N09C21115.3°121.5°
N09C10H102108.0°108.8°
N09C10H101108.0°108.8°
C10C11N12118.9°110.2°
C10C11H112107.1°109.4°
C10C11H111107.0°109.3°
C11C10H102108.1°108.8°
C11C10H101108.0°108.8°
C11N12C13118.9°128.1°
C11N12C20133.2°122.2°
N12C11H112107.0°109.4°
N12C11H111107.1°109.3°
N12C13C14111.4°109.8°
C13N12C20108.0°109.6°
N12C13H131124.3°125.1°
C13C14C15103.6°106.7°
C13C14C23125.6°126.7°
C14C13H131124.3°125.1°
C15C16C17118.0°119.5°
C16C15C14133.6°135.1°
C16C15C20116.3°119.1°
C15C16H161121.0°120.2°
C16C17C18126.2°120.9°
C16C17F22115.5°119.5°
C17C16H161121.0°120.3°
C18C19C20120.2°119.5°
C18C19C21119.7°120.9°
C19C18C17115.3°120.0°
C19C18H181122.4°120.0°
C20C19C21120.1°119.4°
C19C20N12129.0°131.5°
C19C20C15124.1°120.8°
C19C21N09119.6°108.2°
C19C21H212106.9°109.7°
C19C21H211106.9°109.7°
C18C17F22118.3°119.6°
C17C18H181122.4°120.0°
C15C14C23129.8°126.6°
C14C15C20110.0°105.8°
C14C23C24129.8°126.9°
C14C23C28121.8°127.0°
C23C24C25108.6°105.9°
C23C24C30132.2°127.1°
C24C23C28107.4°106.1°
O26C25N27122.9°125.7°
O26C25C24128.4°125.8°
C25N27C28108.3°110.7°
N27C25C24108.7°108.5°
C25N27H271125.9°124.6°
N27C28O29121.6°125.6°
N27C28C23106.8°108.8°
C28N27H271125.9°124.7°
O29C28C23131.6°125.6°
C25C24C30119.1°127.0°
C24C30C31128.4°126.8°
C24C30N34129.2°126.7°
C30C31N32114.8°108.2°
C31C30N34102.4°106.5°
C30C31H311122.6°125.9°
C31N32C33105.1°109.8°
N32C31H311122.6°125.9°
N32C33N34108.6°108.6°
N32C33C38132.1°131.9°
C33N34C35117.7°120.6°
C33N34C30109.0°106.9°
N34C33C38119.3°119.5°
N34C35C36120.9°120.6°
C35N34C30133.3°132.5°
N34C35H351119.5°119.7°
C35C36C37122.9°120.1°
C36C35H351119.5°119.7°
C35C36H361118.6°119.9°
C36C37C38118.6°119.7°
C37C36H361118.6°119.9°
C36C37H371120.7°120.2°
C37C38C33120.6°119.4°
C38C37H371120.7°120.1°
C37C38H381119.7°120.3°
C06C01H012109.4°109.5°
C06C01H011109.4°109.5°
C01C06H061109.4°109.5°
C01C06H062109.4°109.5°
N09C21H212106.9°109.7°
N09C21H211106.9°109.8°
N12C20C15107.0°107.6°
C33C38H381119.7°120.3°
H112C11H111109.5°109.3°
H012C01H011109.5°109.4°
H021C02H022109.5°109.4°
H031C03H032109.5°109.5°
H052C05H051109.5°109.6°
H061C06H062109.5°109.5°
H102C10H101109.5°108.7°
H212C21H211109.5°109.8°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C01C02C03H021120.3°120.0°
C01C02C03H022120.3°120.0°
C01C02C03N0449.9°54.6°
C02C01C06C0518.8°61.4°
C02C01C06H012120.1°120.1°
C02C01C06H011120.1°120.1°
C02C01H012H011119.8°119.9°
C01C02H021H022119.0°120.0°
C01C02C03H03170.9°65.2°
C01C02C03H032170.6°174.6°
C02C01C06H061101.2°58.6°
C02C01C06H062138.8°178.7°
C02C03N04H031120.8°119.8°
C02C03N04H032120.8°119.9°
C02C03N04C052.2°53.6°
C02C03N04C07170.5°126.4°
C03C02C01C0638.4°61.4°
C03C02C01H012158.4°178.6°
C03C02C01H01181.7°58.7°
C03C02H021H022118.9°120.1°
C02C03H031H032117.6°120.2°
C03N04C05C0662.6°53.6°
C03N04C05C07173.3°180.0°
C03N04C07O08176.7°159.1°
C03N04C07N095.0°20.9°
N04C03C02H021170.2°174.6°
N04C03C02H02270.5°65.3°
N04C03H031H032117.6°120.4°
C03N04C05H05257.2°173.4°
C03N04C05H051177.7°66.4°
C06C05N04H052119.7°119.8°
C06C05N04H051119.7°120.0°
C06C05N04C07110.7°126.4°
C05C06C01H061120.0°119.9°
C05C06C01H062120.1°119.9°
C05C06C01H012101.3°178.6°
C05C06C01H011138.8°58.7°
C06C05H052H051120.8°120.4°
C05C06H061H062119.9°120.1°
C05N04C07O085.1°20.8°
C05N04C07N09176.6°159.1°
N04C05C06C0175.4°54.7°
C05N04C03H031123.0°66.2°
C05N04C03H032118.6°173.5°
N04C05H052H051120.9°120.3°
N04C05C06H06144.6°65.3°
N04C05C06H062164.6°174.6°
N04C07O08N09178.7°179.9°
N04C07N09C10175.2°5.9°
N04C07N09C214.4°174.1°
C07N04C03H03149.7°113.8°
C07N04C03H03268.8°6.5°
C07N04C05H052129.6°6.6°
C07N04C05H0519.0°113.7°
O08C07N09C103.2°174.0°
O08C07N09C21177.1°6.0°
C07N09C10C21179.7°180.0°
C07N09C10C11121.5°148.2°
C07N09C21C1986.4°94.2°
C07N09C10H1020.6°90.9°
C07N09C10H101117.7°27.3°
C07N09C21H21235.1°25.5°
C07N09C21H211152.2°146.1°
N09C10C11H102120.8°120.9°
N09C10C11H101120.8°120.9°
N09C10C11N122.5°52.8°
C10N09C21C1993.3°85.8°
N09C10C11H112118.9°173.0°
N09C10C11H111123.8°67.3°
N09C10H102H101117.4°118.3°
C10N09C21H212145.3°154.5°
C10N09C21H21128.1°33.8°
C10C11N12H112121.3°120.2°
C10C11N12H111121.3°120.1°
C10C11N12C13159.1°116.7°
C11C10N09C2158.2°31.8°
C10C11N12C2021.0°66.3°
C10C11H112H111115.7°119.7°
C11C10H102H101117.4°118.3°
C11N12C13C20179.9°177.2°
C11N12C13C14178.4°172.1°
C11N12C20C190.1°6.8°
C11N12C20C15179.4°170.5°
N12C11H112H111115.7°119.6°
N12C11C10H102123.3°173.6°
N12C11C10H101118.4°68.1°
C11N12C13H1311.6°8.0°
N12C13C14H131180.0°179.9°
C13N12C20C19179.8°175.8°
N12C13C14C152.9°1.3°
N12C13C14C23172.6°178.7°
C13N12C20C150.7°6.9°
C13N12C11H11237.8°3.5°
C13N12C11H11179.5°123.2°
C13C14C15C16179.5°176.1°
C13C14C15C23169.0°180.0°
C13C14C23C24139.1°75.3°
C14C13N12C201.5°5.1°
C13C14C15C203.4°2.9°
C13C14C23C2828.1°105.1°
C15C16C17H161180.0°180.0°
C16C15C20C191.0°4.3°
C15C16C17C181.4°1.1°
C15C16C17F22179.9°178.9°
C16C15C14C20176.1°179.0°
C16C15C14C2311.5°3.8°
C16C15C20N12179.4°173.3°
C16C17C18C191.0°0.3°
C16C17C18F22178.7°180.0°
C17C16C15C14177.2°179.9°
C17C16C15C201.3°1.1°
C16C17C18H181179.0°179.7°
C18C19C20C21179.1°175.9°
C19C18C17H181180.0°179.9°
C19C18C17F22179.7°179.7°
C18C19C21N09130.5°136.0°
C18C19C20N12179.8°171.8°
C18C19C20C150.7°5.2°
C18C19C21H2129.1°16.4°
C18C19C21H211108.1°104.3°
C20C19C18C170.6°2.9°
C19C20C15C14177.9°176.5°
C20C19C21N0948.6°39.9°
C19C20N12C15179.5°177.3°
C20C19C18H181179.4°177.2°
C20C19C21H212170.0°159.5°
C20C19C21H21172.8°79.8°
C21C19C18C17178.6°173.0°
C19C21N09H212121.4°119.6°
C19C21N09H211121.4°119.7°
C21C19C20N121.0°12.3°
C21C19C20C15178.4°170.8°
C21C19C18H1811.4°7.0°
C19C21H212H211115.4°120.6°
C18C17C16H161178.7°178.9°
F22C17C16H1610.1°1.1°
F22C17C18H1810.3°0.3°
C15C14C23C2427.7°104.7°
C14C15C20N122.5°5.9°
C15C14C23C28165.0°75.0°
C15C14C13H131177.0°178.6°
C14C15C16H1612.8°0.1°
C14C23C24C28168.6°179.7°
C14C23C28N27173.5°179.9°
C14C23C28O298.2°0.0°
C14C23C24C25172.2°180.0°
C14C23C24C309.7°0.0°
C23C14C15C20172.4°177.1°
C23C14C13H1317.4°1.4°
C23C24C25O26177.6°179.9°
C23C24C25N272.2°0.0°
C24C23C28N273.7°0.4°
C24C23C28O29177.9°179.7°
C23C24C25C30178.4°180.0°
C23C24C30C31130.8°58.4°
C23C24C30N3449.1°121.9°
O26C25N27C24179.8°179.9°
O26C25N27C28179.9°179.8°
O26C25C24C300.8°0.1°
O26C25N27H2710.1°0.2°
C25N27C28H271180.0°179.6°
C25N27C28O29179.1°179.7°
N27C25C24C30179.5°180.0°
C25N27C28C232.4°0.4°
N27C28O29C23178.1°179.9°
C28N27C25C240.3°0.3°
O29C28N27H2710.9°0.1°
C25C24C30C3147.1°121.6°
C25C24C23C283.5°0.3°
C25C24C30N34132.9°58.1°
C24C25N27H271179.7°179.9°
C24C30C31N34180.0°179.8°
C24C30C31N32178.9°180.0°
C24C30N34C33179.7°179.8°
C24C30N34C351.2°0.0°
C30C24C23C28178.4°179.8°
C24C30C31H3111.1°0.0°
C30C31N32H311180.0°180.0°
C30C31N32C331.5°0.0°
C31C30N34C330.3°0.4°
C31C30N34C35178.8°179.7°
C31N32C33N341.1°0.3°
N32C31C30N341.1°0.3°
C31N32C33C38179.1°180.0°
N32C33N34C38179.8°179.8°
N32C33N34C35179.8°179.7°
N32C33C38C37178.9°179.2°
N32C33N34C300.5°0.4°
C33N32C31H311178.6°180.0°
N32C33C38H3811.0°0.0°
C33N34C35C30179.1°179.9°
C33N34C35C361.5°0.2°
N34C33C38C370.8°0.5°
C33N34C35H351178.5°179.8°
N34C33C38H381179.2°179.7°
N34C35C36H351180.0°180.0°
N34C35C36C371.5°0.0°
C35N34C33C380.4°0.1°
N34C35C36H361178.5°180.0°
C35C36C37H361180.0°180.0°
C35C36C37C380.3°0.5°
C36C35N34C30179.4°180.0°
C35C36C37H371179.8°180.0°
C36C37C38H371180.0°179.5°
C36C37C38C330.9°0.7°
C37C36C35H351178.5°180.0°
C36C37C38H381179.1°179.9°
C37C38C33H381180.0°179.2°
C38C37C36H361179.7°179.5°
C06C01H012H011119.8°120.0°
C06C01C02H021158.7°178.7°
C06C01C02H02282.0°58.6°
C01C06C05H05244.3°174.4°
C01C06C05H051164.9°65.3°
C01C06H061H062119.8°120.1°
C21N09C10H102179.1°89.1°
C21N09C10H10162.6°152.7°
N09C21H212H211115.4°120.7°
C20N12C11H112142.3°173.4°
C20N12C11H111100.4°53.8°
C20N12C13H131178.4°174.8°
C20C15C16H161178.7°178.9°
C23C28N27H271177.6°180.0°
C30N34C33C38179.7°179.8°
N34C30C31H311178.9°179.8°
C30N34C35H3510.6°0.1°
C33C38C37H371179.1°179.8°
H112C11C10H1022.0°66.1°
H112C11C10H101120.3°52.1°
H111C11C10H102115.4°53.6°
H111C11C10H1013.0°171.8°
H012C01C02H02181.2°58.6°
H012C01C02H02238.1°61.4°
H012C01C06H061138.7°61.5°
H012C01C06H06218.8°58.7°
H011C01C02H02138.6°61.3°
H011C01C02H022158.0°178.7°
H011C01C06H06118.8°178.7°
H011C01C06H062101.1°61.2°
H021C02C03H03149.4°54.8°
H021C02C03H03269.0°65.4°
H022C02C03H031168.8°174.8°
H022C02C03H03250.3°54.6°
H052C05C06H061164.4°54.5°
H052C05C06H06275.7°65.6°
H051C05C06H06175.1°174.8°
H051C05C06H06244.9°54.7°
H351C35C36H3611.5°0.0°
H361C36C37H3710.2°0.0°
H371C37C38H3810.9°0.6°

248636

PDB entries from 2026-02-04

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