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KA6

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N01C02sing1.47Å1.42Å
C02C03sing1.53Å1.50Å
C03O04sing1.43Å1.43Å
O04C05sing1.43Å1.42Å
N01C06sing1.47Å1.42Å
C05C06sing1.53Å1.48Å
C07C08sing1.54Å1.48Å
C08C09sing1.54Å1.53Å
C09N10sing1.49Å1.43Å
C07C11sing1.54Å1.50Å
N10C11sing1.49Å1.42Å
N12C13sing1.39Å1.39Å
C13C14sing1.41Å1.42ÅAromatic
C14C15doub1.35Å1.45ÅAromatic
C13C16doub1.38Å1.41ÅAromatic
C16C17sing1.40Å1.47ÅAromatic
C15N18sing1.36Å1.42ÅAromatic
C17N18sing1.37Å1.38ÅAromatic
N18N19sing1.40Å1.39ÅAromatic
N10C20sing1.39Å1.43Å
N19C20doub1.32Å1.36ÅAromatic
C17N21doub1.33Å1.38ÅAromatic
C20N21sing1.33Å1.38ÅAromatic
N22C23sing1.36Å1.33ÅAromatic
C23C24doub1.39Å1.36ÅAromatic
C24C25sing1.41Å1.38ÅAromatic
N22N26sing1.40Å1.40ÅAromatic
C25N26doub1.31Å1.35ÅAromatic
N22C27sing1.46Å1.43Å
N12C28sing1.35Å1.39Å
C23C28sing1.47Å1.53Å
N01C29sing1.35Å1.41Å
C24C29sing1.48Å1.50Å
C29O30doub1.21Å1.23Å
C28O31doub1.22Å1.24Å
C02H33sing1.09Å1.10Å
C02H32sing1.09Å1.10Å
C05H37sing1.09Å1.10Å
C05H36sing1.09Å1.10Å
C06H39sing1.09Å1.10Å
C06H38sing1.09Å1.10Å
C07H41sing1.09Å1.10Å
C07H40sing1.09Å1.10Å
C11H47sing1.09Å1.10Å
C11H46sing1.09Å1.10Å
C15H50sing1.08Å1.08Å
C16H51sing1.08Å1.08Å
C25H52sing1.08Å1.08Å
C27H54sing1.09Å1.10Å
C27H53sing1.09Å1.10Å
C27H55sing1.09Å1.10Å
C03H34sing1.09Å1.10Å
C03H35sing1.09Å1.10Å
C08H43sing1.09Å1.10Å
C08H42sing1.09Å1.10Å
C09H44sing1.09Å1.10Å
C09H45sing1.09Å1.10Å
N12H48sing0.97Å1.00Å
C14H49sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N01C02C03107.6°108.4°
C02N01C06115.1°118.0°
C02N01C29116.2°121.0°
N01C02H33109.9°109.7°
N01C02H32109.9°109.7°
C02C03O04105.6°109.2°
C03C02H33109.9°109.7°
C03C02H32109.9°109.7°
C02C03H34110.4°109.5°
C02C03H35110.4°109.5°
C03O04C05110.3°114.1°
O04C03H34110.4°109.5°
O04C03H35110.4°109.5°
O04C05C06106.9°109.2°
O04C05H37110.1°109.5°
O04C05H36110.1°109.6°
N01C06C05108.5°108.4°
C06N01C29127.7°121.0°
N01C06H39109.7°109.7°
N01C06H38109.7°109.7°
C06C05H37110.1°109.5°
C06C05H36110.1°109.5°
C05C06H39109.7°109.7°
C05C06H38109.7°109.7°
C07C08C09107.4°105.1°
C08C07C11103.7°105.0°
C08C07H41110.9°110.3°
C08C07H40110.9°110.3°
C07C08H43110.0°110.3°
C07C08H42110.0°110.3°
C08C09N1099.2°104.6°
C09C08H43110.0°110.4°
C09C08H42110.0°110.4°
C08C09H44112.0°110.4°
C08C09H45111.9°110.4°
C09N10C11115.4°104.3°
C09N10C20114.1°111.0°
N10C09H44112.0°110.5°
N10C09H45112.0°110.5°
C07C11N10104.8°104.6°
C11C07H41110.9°110.3°
C11C07H40110.9°110.3°
C07C11H47110.6°110.4°
C07C11H46110.6°110.4°
C11N10C20130.2°111.0°
N10C11H47110.6°110.4°
N10C11H46110.6°110.5°
N12C13C14116.5°120.4°
N12C13C16122.2°120.3°
C13N12C28119.9°120.0°
C13N12H48120.1°120.0°
C13C14C15120.6°120.1°
C14C13C16121.3°119.3°
C13C14H49119.7°119.9°
C14C15N18118.2°120.9°
C14C15H50120.9°119.6°
C15C14H49119.7°120.0°
C13C16C17116.3°119.1°
C13C16H51121.8°120.4°
C16C17N18123.1°119.8°
C16C17N21128.2°132.6°
C17C16H51121.8°120.5°
C15N18C17120.1°120.8°
C15N18N19129.3°132.9°
N18C15H50120.9°119.6°
C17N18N19110.3°106.2°
N18C17N21108.7°107.5°
N18N19C20103.0°107.2°
N10C20N19122.4°125.3°
N10C20N21123.3°125.3°
N19C20N21114.3°109.5°
C17N21C20103.7°109.6°
N22C23C24108.4°107.0°
C23N22N26110.8°108.2°
C23N22C27123.8°125.9°
N22C23C28124.4°126.5°
C23C24C25105.9°107.2°
C24C23C28127.1°126.5°
C23C24C29132.3°126.4°
C24C25N26111.5°108.5°
C25C24C29121.6°126.4°
C24C25H52124.3°125.7°
N22N26C25103.3°109.2°
N26N22C27125.4°125.9°
N26C25H52124.3°125.8°
N22C27H54109.5°109.5°
N22C27H53109.5°109.5°
N22C27H55109.5°109.5°
N12C28C23112.6°120.0°
N12C28O31123.7°120.0°
C28N12H48120.0°120.0°
C23C28O31123.7°119.9°
N01C29C24126.7°120.0°
N01C29O30114.5°120.0°
C24C29O30117.6°120.0°
H33C02H32109.5°109.7°
H37C05H36109.5°109.5°
H39C06H38109.5°109.7°
H41C07H40109.5°110.4°
H47C11H46109.5°110.4°
H54C27H53109.5°109.4°
H54C27H55109.5°109.4°
H53C27H55109.5°109.5°
H34C03H35109.5°109.5°
H43C08H42109.5°110.3°
H44C09H45109.5°110.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N01C02C03H33119.7°119.7°
N01C02C03H32119.7°119.8°
N01C02C03O0459.0°52.3°
C02N01C06C29168.0°180.0°
C02N01C06C0556.0°50.5°
C02N01C29C2432.9°4.6°
C02N01C29O30160.0°175.5°
N01C02H33H32120.8°120.6°
C02N01C06H3963.8°170.2°
C02N01C06H38175.9°69.2°
N01C02C03H3460.4°67.6°
N01C02C03H35178.4°172.2°
C02C03O04H34119.4°119.9°
C02C03O04H35119.4°119.9°
C02C03O04C0567.8°62.6°
C03C02N01C0656.6°50.5°
C03C02N01C29112.8°129.5°
C03C02H33H32120.9°120.5°
C02C03H34H35121.8°120.1°
C03O04C05C0667.5°62.6°
O04C03C02H33178.7°172.1°
O04C03C02H3260.7°67.4°
C03O04C05H3752.1°177.5°
C03O04C05H36172.9°57.4°
O04C03H34H35121.8°120.1°
O04C05C06N0157.9°52.3°
O04C05C06H37119.6°119.9°
O04C05C06H36119.6°120.0°
O04C05H37H36121.2°120.2°
O04C05C06H3962.0°172.0°
O04C05C06H38177.7°67.4°
C05O04C03H3451.6°57.3°
C05O04C03H35172.8°177.5°
N01C06C05H39119.8°119.7°
N01C06C05H38119.9°119.8°
C06N01C29C24159.2°175.5°
C06N01C29O307.9°4.5°
C06N01C02H33176.3°170.3°
C06N01C02H3263.1°69.2°
N01C06C05H3761.7°172.2°
N01C06C05H36177.5°67.7°
N01C06H39H38120.5°120.6°
C05C06N01C29112.0°129.5°
C06C05H37H36121.2°120.1°
C05C06H39H38120.4°120.5°
C07C08C09H43119.7°118.9°
C07C08C09H42119.7°118.9°
C07C08C09N1028.9°23.8°
C08C07C11H41119.1°118.9°
C08C07C11H40119.1°118.9°
C08C07C11N1019.0°23.8°
C08C07H41H40122.6°122.2°
C08C07C11H47138.3°94.9°
C08C07C11H46100.2°142.8°
C07C08H43H42120.9°122.1°
C07C08C09H44147.2°142.7°
C07C08C09H4589.4°95.0°
C08C09N10H44118.3°118.8°
C08C09N10H45118.3°118.7°
C09C08C07C1130.4°0.0°
C08C09N10C1117.3°39.5°
C08C09N10C20167.8°159.1°
C09C08C07H4188.7°118.8°
C09C08C07H40149.5°118.9°
C09C08H43H42121.0°122.3°
C08C09H44H45124.8°122.3°
C09N10C11C070.5°39.5°
C09N10C11C20173.9°119.6°
C09N10C20N197.3°0.1°
C09N10C20N21169.7°180.0°
C09N10C11H47119.8°79.3°
C09N10C11H46118.7°158.3°
N10C09C08H4390.8°95.0°
N10C09C08H42148.6°142.7°
N10C09H44H45124.8°122.5°
C07C11N10H47119.3°118.7°
C07C11N10H46119.2°118.8°
C07C11N10C20173.4°159.0°
C11C07H41H40122.7°122.2°
C07C11H47H46122.2°122.4°
C11C07C08H4389.3°118.9°
C11C07C08H42150.1°119.0°
C11N10C20N19178.7°115.4°
C11N10C20N214.3°64.5°
N10C11C07H41100.0°95.0°
N10C11C07H40138.1°142.7°
N10C11H47H46122.2°122.5°
C11N10C09H44135.6°158.3°
C11N10C09H45101.0°79.3°
N12C13C14C16179.3°179.7°
N12C13C14C15177.9°179.7°
N12C13C16C17178.0°179.7°
C13N12C28H48180.0°180.0°
C13N12C28C23179.3°174.7°
C13N12C28O312.5°5.3°
N12C13C16H512.0°0.3°
N12C13C14H492.1°0.3°
C13C14C15H49180.0°179.9°
C14C13C16C172.8°0.0°
C13C14C15N186.5°0.0°
C14C13N12C28165.6°6.6°
C13C14C15H50173.5°179.9°
C14C13C16H51177.2°180.0°
C14C13N12H4814.4°173.5°
C15C14C13C161.4°0.0°
C14C15N18H50180.0°180.0°
C14C15N18C177.2°0.0°
C14C15N18N19179.8°180.0°
C13C16C17H51180.0°180.0°
C13C16C17N182.1°0.0°
C13C16C17N21178.6°180.0°
C16C13N12C2815.1°173.1°
C16C13N12H48164.9°6.8°
C16C13C14H49178.6°180.0°
C16C17N18C153.0°0.0°
C16C17N18N21179.5°180.0°
C16C17N18N19176.9°180.0°
C16C17N21C20178.0°180.0°
C15N18C17N19173.9°180.0°
C15N18N19C20175.6°180.0°
C15N18C17N21176.4°180.0°
N18C15C14H49173.6°180.0°
C17N18N19C202.5°0.0°
N18C17N21C201.4°0.0°
C17N18C15H50172.8°179.9°
N18C17C16H51177.9°180.0°
N18N19C20N10178.8°180.0°
N19N18C17N212.5°0.0°
N18N19C20N211.6°0.1°
N19N18C15H500.2°0.0°
N10C20N19N21177.2°179.9°
N10C20N21C17177.3°180.0°
C20N10C11H4754.1°40.3°
C20N10C11H4667.4°82.1°
C20N10C09H4449.5°82.1°
C20N10C09H4573.9°40.3°
N19C20N21C170.2°0.1°
N21C17C16H511.4°0.0°
N22C23C24C28177.3°179.7°
N22C23C24C252.6°0.2°
C23N22N26C27176.8°179.5°
C23N22N26C252.1°0.5°
N22C23C28N12144.1°79.7°
N22C23C24C29177.3°179.7°
N22C23C28O3137.6°100.3°
C23N22C27H54176.4°85.0°
C23N22C27H5356.4°155.0°
C23N22C27H5563.6°34.9°
C23C24C25C29175.4°179.9°
C24C23N22N263.1°0.4°
C23C24C25N261.3°0.1°
C24C23N22C27179.9°180.0°
C24C23C28N1232.8°99.9°
C23C24C29N01145.6°126.0°
C23C24C29O3047.6°54.0°
C24C23C28O31145.5°80.1°
C23C24C25H52178.7°180.0°
C24C25N26N220.4°0.3°
C24C25N26H52180.0°179.9°
C25C24C23C28180.0°179.9°
C25C24C29N0128.4°54.1°
C25C24C29O30138.4°125.9°
N26N22C23C28179.5°179.9°
N22N26C25H52179.6°179.8°
N26N22C27H540.0°95.5°
N26N22C27H53120.0°24.4°
N26N22C27H55120.0°144.5°
C25N26N22C27179.0°180.0°
N26C25C24C29176.7°180.0°
C27N22C23C282.7°0.3°
N22C27H54H53120.0°120.1°
N22C27H54H55120.0°119.9°
N22C27H53H55120.0°120.1°
N12C28C23O31178.3°180.0°
C28C23C24C295.4°0.0°
C23C28N12H480.8°5.2°
N01C29C24O30166.8°180.0°
C29N01C02H336.9°9.8°
C29N01C02H32127.4°110.8°
C29N01C06H39128.1°9.8°
C29N01C06H387.8°110.8°
C29C24C25H523.3°0.1°
O31C28N12H48177.5°174.8°
H33C02C03H3459.3°52.1°
H33C02C03H3561.9°68.0°
H32C02C03H34179.9°172.6°
H32C02C03H3558.6°52.5°
H37C05C06H39178.5°68.1°
H37C05C06H3858.2°52.5°
H36C05C06H3957.6°52.0°
H36C05C06H3862.7°172.6°
H41C07C11H4719.2°146.2°
H41C07C11H46140.8°23.9°
H41C07C08H43151.7°0.1°
H41C07C08H4231.0°122.2°
H40C07C11H47102.6°24.0°
H40C07C11H4618.9°98.4°
H40C07C08H4329.8°122.2°
H40C07C08H4290.8°0.1°
H50C15C14H496.5°0.0°
H54C27H53H55120.0°119.9°
H43C08C09H4427.6°23.8°
H43C08C09H45150.9°146.2°
H42C08C09H4493.1°98.4°
H42C08C09H4530.3°23.9°

224931

PDB entries from 2024-09-11

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