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SummaryGeometryRelated PDB entries

KIN

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C11C13doub1.39Å1.40ÅAromatic
C11C09sing1.40Å1.41ÅAromatic
C11H11sing1.09Å1.08Å
C13C05sing1.39Å1.40ÅAromatic
C13H13sing1.09Å1.08Å
C21C22doub1.39Å1.41ÅAromatic
C21C29sing1.38Å1.40ÅAromatic
C21N19sing1.41Å1.41Å
C22C24sing1.39Å1.41ÅAromatic
C22H22sing1.09Å1.08Å
C24C26doub1.39Å1.40ÅAromatic
C24H24sing1.09Å1.08Å
C27C26sing1.40Å1.41ÅAromatic
C27C29doub1.39Å1.41ÅAromatic
C27H27sing1.09Å1.08Å
C32C33doub1.38Å1.40ÅAromatic
C32C40sing1.38Å1.40ÅAromatic
C32O31sing1.38Å1.36Å
C33C35sing1.39Å1.39ÅAromatic
C33H33sing1.08Å1.08Å
C35N37doub1.35Å1.34ÅAromatic
C35H35sing1.09Å1.08Å
F01C02sing1.37Å1.38Å
C02F04sing1.37Å1.38Å
C02F03sing1.37Å1.38Å
C02C05sing1.49Å1.51Å
C05C06doub1.40Å1.41ÅAromatic
C06C08sing1.40Å1.41ÅAromatic
C06H06sing1.09Å1.08Å
C08N15sing1.40Å1.42Å
C08C09doub1.39Å1.41ÅAromatic
C09H09sing1.09Å1.08Å
N15C17sing1.42Å1.35Å
N15HN15sing1.03Å1.00Å
C17O18doub1.23Å1.27Å
C17N19sing1.40Å1.35Å
N19HN19sing1.02Å1.00Å
C26O31sing1.36Å1.36Å
C29H29sing1.09Å1.08Å
N37C38sing1.35Å1.34ÅAromatic
C38C40doub1.39Å1.39ÅAromatic
C38H38sing1.09Å1.08Å
C40H40sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C13C11C09120.2°120.0°
C13C11H11119.9°120.0°
C11C13C05119.8°120.0°
C11C13H13120.1°119.5°
C09C11H11119.9°120.0°
C11C09C08121.1°120.0°
C11C09H09119.4°119.3°
C05C13H13120.1°120.5°
C13C05C02121.1°120.0°
C13C05C06119.6°120.0°
C22C21C29118.0°121.4°
C22C21N19122.5°119.3°
C21C22C24121.6°119.3°
C21C22H22119.2°121.3°
C29C21N19119.4°119.3°
C21C29C27120.6°119.3°
C21C29H29119.7°121.3°
C21N19C17120.3°128.0°
C21N19HN19119.9°116.0°
C24C22H22119.2°119.4°
C22C24C26120.1°120.0°
C22C24H24119.9°119.7°
C26C24H24119.9°120.3°
C24C26C27118.7°120.0°
C24C26O31121.9°120.0°
C26C27C29121.0°120.0°
C26C27H27119.5°120.4°
C27C26O31119.5°120.0°
C29C27H27119.5°119.6°
C27C29H29119.7°119.4°
C33C32C40117.8°121.5°
C33C32O31121.4°119.3°
C32C33C35119.1°117.0°
C32C33H33120.4°122.2°
C40C32O31120.8°119.3°
C32C40C38118.7°117.0°
C32C40H40120.7°122.2°
C32O31C26120.9°117.7°
C35C33H33120.5°120.8°
C33C35N37123.2°124.1°
C33C35H35118.4°120.8°
N37C35H35118.4°115.2°
C35N37C38117.8°116.3°
F01C02F04108.4°105.6°
F01C02F03108.3°105.1°
F01C02C05113.4°113.6°
F04C02F03108.4°105.5°
F04C02C05111.0°112.6°
F03C02C05107.2°113.6°
C02C05C06119.4°120.0°
C05C06C08121.4°120.0°
C05C06H06119.3°119.9°
C08C06H06119.3°120.1°
C06C08N15122.9°120.0°
C06C08C09118.0°120.0°
N15C08C09119.1°120.0°
C08N15C17121.0°128.6°
C08N15HN15119.5°116.5°
C08C09H09119.5°120.7°
C17N15HN15119.5°114.8°
N15C17O18123.9°124.7°
N15C17N19112.5°110.0°
O18C17N19123.5°125.3°
C17N19HN19119.9°115.9°
N37C38C40123.4°124.1°
N37C38H38118.3°115.1°
C40C38H38118.3°120.8°
C38C40H40120.7°120.8°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
C13C11C09H11180.0°180.0°
C11C13C05H13180.0°180.0°
C11C13C05C02178.2°179.9°
C11C13C05C060.5°0.1°
C13C11C09C081.7°0.0°
C13C11C09H09178.3°180.0°
C09C11C13C050.5°0.1°
C09C11C13H13179.6°180.0°
C11C09C08C061.9°0.0°
C11C09C08N15179.1°179.9°
C11C09C08H09180.0°180.0°
H11C11C13C05179.6°180.0°
H11C11C13H130.4°0.0°
H11C11C09C08178.3°180.0°
H11C11C09H091.6°0.0°
C13C05C02F0111.0°0.1°
C13C05C02F04133.4°120.0°
C13C05C02F03108.4°120.1°
C13C05C02C06178.7°179.8°
C13C05C06C080.2°0.0°
C13C05C06H06179.8°180.0°
H13C13C05C021.8°0.1°
H13C13C05C06179.5°180.0°
C22C21C29N19178.0°179.9°
C21C22C24H22180.0°180.0°
C21C22C24C261.3°0.0°
C21C22C24H24178.7°180.0°
C22C21C29C270.1°0.0°
C22C21N19C1733.9°180.0°
C22C21N19HN19146.1°0.1°
C22C21C29H29179.8°179.9°
C29C21C22C240.4°0.0°
C29C21C22H22179.6°180.0°
C21C29C27C260.7°0.0°
C21C29C27H29180.0°180.0°
C21C29C27H27179.3°180.0°
C29C21N19C17148.2°0.1°
C29C21N19HN1931.8°179.9°
N19C21C22C24178.3°179.9°
N19C21C22H221.7°0.1°
N19C21C29C27178.1°179.9°
C21N19C17N15177.3°180.0°
C21N19C17O182.2°0.1°
C21N19C17HN19180.0°179.9°
N19C21C29H291.9°0.1°
C22C24C26H24180.0°180.0°
C22C24C26C271.8°0.0°
C22C24C26O31179.7°179.9°
H22C22C24C26178.7°180.0°
H22C22C24H241.3°0.0°
C24C26C27O31178.5°179.9°
C24C26C27C291.5°0.0°
C24C26C27H27178.5°180.0°
C24C26O31C3282.7°135.0°
H24C24C26C27178.2°180.0°
H24C24C26O310.3°0.1°
C26C27C29H27180.0°180.0°
C27C26O31C3295.8°45.1°
C26C27C29H29179.3°180.0°
C29C27C26O31180.0°179.9°
H27C27C26O310.0°0.0°
H27C27C29H290.7°0.1°
C33C32C40O31178.9°179.9°
C32C33C35H33180.0°180.0°
C32C33C35N370.0°0.0°
C32C33C35H35180.0°180.0°
C33C32O31C2625.3°45.0°
C33C32C40C380.1°0.1°
C33C32C40H40179.9°180.0°
C40C32C33C350.1°0.1°
C40C32C33H33179.9°179.9°
C40C32O31C26153.6°135.1°
C32C40C38N370.6°0.1°
C32C40C38H40180.0°180.0°
C32C40C38H38179.5°180.0°
O31C32C33C35178.8°179.9°
O31C32C33H331.2°0.0°
O31C32C40C38179.1°180.0°
O31C32C40H400.9°0.1°
C33C35N37H35180.0°180.0°
C33C35N37C380.4°0.0°
H33C33C35N37180.0°180.0°
H33C33C35H350.0°0.0°
C35N37C38C400.7°0.0°
C35N37C38H38179.3°180.0°
H35C35N37C38179.6°180.0°
F01C02F04F03117.4°111.0°
F01C02F04C05125.2°124.5°
F01C02F03C05122.6°124.9°
F01C02C05C06170.3°179.9°
F04C02F03C05119.9°123.8°
F04C02C05C0647.9°60.1°
F03C02C05C0670.3°59.7°
C02C05C06C08178.5°179.9°
C02C05C06H061.5°0.1°
C05C06C08H06180.0°180.0°
C05C06C08N15179.9°179.9°
C05C06C08C091.0°0.0°
C06C08N15C09178.9°179.9°
C06C08C09H09178.1°180.0°
C06C08N15C1727.4°179.9°
C06C08N15HN15152.6°0.1°
H06C06C08N150.1°0.1°
H06C06C08C09179.0°180.0°
N15C08C09H090.8°0.1°
C08N15C17HN15180.0°180.0°
C08N15C17O183.7°0.0°
C08N15C17N19175.8°180.0°
C09C08N15C17151.5°0.0°
C09C08N15HN1528.5°180.0°
N15C17O18N19179.5°180.0°
N15C17N19HN192.6°0.0°
HN15N15C17O18176.3°179.9°
HN15N15C17N194.2°0.0°
O18C17N19HN19177.9°180.0°
N37C38C40H38180.0°179.9°
N37C38C40H40179.4°180.0°
H38C38C40H400.6°0.0°

227111

PDB entries from 2024-11-06

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