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CKG

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O9C8doub1.22Å1.22Å
C8N24sing1.35Å1.34Å
C8C5sing1.48Å1.49Å
C5C4sing1.40Å1.39ÅAromatic
C5N6doub1.32Å1.34ÅAromatic
C4C2sing1.50Å1.52Å
C4C3doub1.38Å1.39ÅAromatic
C2C1sing1.53Å1.54Å
N6N7sing1.29Å1.40ÅAromatic
N7C17sing1.46Å1.47Å
N7C3sing1.35Å1.35ÅAromatic
C17C25sing1.53Å1.53Å
C25C30sing1.53Å1.53Å
C25C26sing1.53Å1.54Å
C30C29sing1.53Å1.52Å
C29N28sing1.47Å1.46Å
N28C27sing1.47Å1.46Å
C27C26sing1.53Å1.52Å
C3C11sing1.47Å1.39ÅAromatic
C11N18sing1.32Å1.35ÅAromatic
C11C10doub1.40Å1.39ÅAromatic
N18C12doub1.33Å1.37ÅAromatic
C12N13sing1.33Å1.35ÅAromatic
C12N15sing1.36Å1.35Å
N13C14doub1.32Å1.34ÅAromatic
C14C10sing1.38Å1.38ÅAromatic
C10C1sing1.50Å1.52Å
N15C16doub1.32Å1.36Å
C16C23sing1.48Å1.39Å
C16C19sing1.48Å1.40Å
C23C22doub1.33Å1.41Å
C22C21sing1.50Å1.40Å
C21C20sing1.50Å1.40Å
C20C19doub1.33Å1.41Å
N24H241sing0.97Å1.00Å
N24H242sing0.97Å1.00Å
C2H21Csing1.09Å1.10Å
C2H22Csing1.09Å1.10Å
C1H11Csing1.09Å1.10Å
C1H12Csing1.09Å1.10Å
C17H171sing1.09Å1.10Å
C17H172sing1.09Å1.10Å
C25H25sing1.09Å1.10Å
C30H301sing1.09Å1.10Å
C30H302sing1.09Å1.10Å
C26H261sing1.09Å1.10Å
C26H262sing1.09Å1.10Å
C29H291sing1.09Å1.10Å
C29H292sing1.09Å1.10Å
N28H28sing1.01Å1.00Å
C27H271sing1.09Å1.10Å
C27H272sing1.09Å1.10Å
C14H14sing1.08Å1.08Å
C23H23sing1.08Å1.08Å
C19H19sing1.08Å1.08Å
C22H22sing1.08Å1.08Å
C21H211sing1.09Å1.10Å
C21H212sing1.09Å1.10Å
C20H20sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O9C8N24121.8°120.0°
O9C8C5122.3°120.0°
N24C8C5115.9°120.0°
C8N24H241112.6°120.0°
C8N24H242123.7°120.0°
C8C5C4127.5°126.5°
C8C5N6123.5°126.4°
C4C5N6109.0°107.1°
C5C4C2130.7°131.8°
C5C4C3107.7°105.6°
C5N6N7106.7°110.6°
C2C4C3121.6°122.6°
C4C2C1109.4°109.7°
C4C2H21C109.5°109.5°
C4C2H22C109.5°109.4°
C4C3N7106.4°107.1°
C4C3C11122.9°120.3°
C2C1C10113.5°112.5°
C1C2H21C109.5°109.4°
C1C2H22C109.5°109.4°
C2C1H11C108.2°108.8°
C2C1H12C107.3°108.9°
N6N7C17115.6°125.2°
N6N7C3110.2°109.6°
C17N7C3134.1°125.2°
N7C17C25114.4°109.5°
N7C17H171107.9°109.5°
N7C17H172106.8°109.4°
N7C3C11130.5°132.6°
C17C25C30110.8°109.5°
C17C25C26109.0°109.5°
C25C17H171107.9°109.5°
C25C17H172106.7°109.4°
C17C25H25109.2°109.5°
C30C25C26110.4°109.2°
C25C30C29110.0°109.3°
C30C25H25107.8°109.6°
C25C30H301109.3°109.5°
C25C30H302109.2°109.5°
C25C26C27110.1°109.3°
C26C25H25109.7°109.6°
C25C26H261109.3°109.5°
C25C26H262109.1°109.5°
C30C29N28112.7°109.5°
C29C30H301109.3°109.5°
C29C30H302109.2°109.5°
C30C29H291108.4°109.5°
C30C29H292107.6°109.5°
C29N28C27118.8°111.2°
N28C29H291108.4°109.4°
N28C29H292107.7°109.4°
C29N28H28106.5°111.0°
N28C27C26110.1°109.6°
C27N28H28106.5°111.1°
N28C27H271109.3°109.4°
N28C27H272109.1°109.4°
C27C26H261109.2°109.5°
C27C26H262109.1°109.5°
C26C27H271109.3°109.5°
C26C27H272109.1°109.5°
C3C11N18122.0°122.9°
C3C11C10118.4°117.2°
N18C11C10119.5°119.9°
C11N18C12120.9°120.1°
C11C10C14118.7°118.0°
C11C10C1120.7°121.3°
N18C12N13119.7°121.4°
N18C12N15124.3°119.3°
N13C12N15116.0°119.3°
C12N13C14120.5°121.4°
C12N15C16131.4°120.0°
N13C14C10120.7°119.2°
N13C14H14119.6°120.4°
C14C10C1120.6°120.7°
C10C14H14119.7°120.4°
C10C1H11C108.2°108.9°
C10C1H12C107.2°108.9°
N15C16C23123.9°121.1°
N15C16C19117.0°121.1°
C23C16C19119.0°117.8°
C16C23C22119.4°119.4°
C16C23H23120.3°120.3°
C16C19C20122.0°119.3°
C16C19H19119.0°120.3°
C23C22C21121.3°123.0°
C22C23H23120.3°120.3°
C23C22H22119.4°118.4°
C22C21C20119.1°113.0°
C21C22H22119.4°118.5°
C22C21H211106.4°108.7°
C22C21H212104.1°108.8°
C21C20C19119.2°123.1°
C20C21H211106.4°108.8°
C20C21H212104.1°108.8°
C21C20H20120.4°118.5°
C20C19H19119.0°120.4°
C19C20H20120.4°118.4°
H241N24H242123.7°120.0°
H21CC2H22C109.4°109.4°
H11CC1H12C112.7°108.8°
H171C17H172113.4°109.5°
H301C30H302109.9°109.5°
H261C26H262110.0°109.6°
H291C29H292112.1°109.5°
H271C27H272110.0°109.5°
H211C21H212117.4°108.6°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O9C8N24C5179.9°179.8°
O9C8C5C48.0°0.0°
O9C8C5N6171.4°179.7°
O9C8N24H241180.0°0.0°
O9C8N24H2420.0°179.9°
N24C8C5C4172.1°179.8°
N24C8C5N68.4°0.5°
C8N24H241H242180.0°179.9°
C8C5C4N6179.5°179.8°
C8C5C4C20.1°1.1°
C8C5C4C3178.6°179.6°
C8C5N6N7180.0°180.0°
C5C8N24H2410.1°179.7°
C5C8N24H242179.9°0.2°
C5C4C2C3178.3°179.3°
C5C4C2C1153.7°149.0°
C4C5N6N70.5°0.2°
C5C4C3N71.8°0.5°
C5C4C3C11177.4°178.7°
C5C4C2H21C33.7°90.8°
C5C4C2H22C86.2°29.1°
N6C5C4C2179.4°179.2°
N6C5C4C30.8°0.2°
C5N6N7C17178.3°179.6°
C5N6N7C31.7°0.5°
C4C2C1H21C120.0°120.1°
C4C2C1H22C120.0°120.0°
C2C4C3N7179.5°178.9°
C2C4C3C114.0°1.9°
C4C2C1C1040.5°45.5°
C4C2H21CH22C120.0°119.9°
C4C2C1H11C79.5°166.2°
C4C2C1H12C158.7°75.3°
C3C4C2C124.6°31.7°
C4C3N7N62.2°0.7°
C4C3N7C17178.0°179.5°
C4C3N7C11175.0°179.1°
C4C3C11N18159.9°167.5°
C4C3C11C1015.7°13.5°
C3C4C2H21C144.6°88.5°
C3C4C2H22C95.4°151.6°
C2C1C10C1133.2°34.6°
C2C1C10C14147.5°147.6°
C2C1C10H11C120.0°120.7°
C2C1C10H12C118.3°120.8°
C1C2H21CH22C120.1°119.8°
C2C1H11CH12C118.4°118.5°
N6N7C17C3175.6°179.8°
N6N7C17C2577.6°89.9°
N6N7C3C11177.2°178.4°
N6N7C17H17142.4°150.0°
N6N7C17H172164.5°30.0°
N7C17C25H171120.0°120.1°
N7C17C25H172117.9°119.9°
N7C17C25C3035.4°175.0°
N7C17C25C2686.3°65.3°
C17N7C3C117.0°1.4°
N7C17H171H172118.0°120.0°
N7C17C25H25153.9°54.9°
C3N7C17C25106.7°90.2°
N7C3C11N1814.5°13.5°
N7C3C11C10170.0°165.5°
C3N7C17H171133.3°29.8°
C3N7C17H17211.1°149.8°
C17C25C30C26120.8°119.9°
C17C25C30H25119.4°120.1°
C17C25C26H25119.5°120.1°
C17C25C30C29177.2°177.6°
C17C25C26C27178.5°177.6°
C25C17H171H172118.0°120.0°
C17C25C30H30162.8°62.5°
C17C25C30H30257.4°57.6°
C17C25C26H26161.5°57.7°
C17C25C26H26258.8°62.5°
C30C25C26H25118.6°120.0°
C25C30C29H301120.0°119.9°
C25C30C29H302119.8°120.0°
C25C30C29N2849.3°59.2°
C30C25C26C2759.5°57.7°
C30C25C17H171155.3°55.0°
C30C25C17H17282.5°65.1°
C25C30H301H302119.8°120.1°
C30C25C26H26160.5°62.2°
C30C25C26H262179.2°177.6°
C25C30C29H29170.8°60.8°
C25C30C29H292167.8°179.2°
C26C25C30C2956.4°57.7°
C25C26C27N2853.7°59.2°
C25C26C27H261120.0°119.9°
C25C26C27H262119.7°119.9°
C26C25C17H17133.7°174.7°
C26C25C17H172155.9°54.6°
C26C25C30H301176.4°177.6°
C26C25C30H30263.4°62.3°
C25C26H261H262119.7°120.1°
C25C26C27H27166.3°60.8°
C25C26C27H272173.4°179.2°
C30C29N28H291120.0°120.1°
C30C29N28H292118.6°120.0°
C30C29N28C2748.0°61.7°
C29C30C25H2563.4°62.3°
C29C30H301H302119.8°120.1°
C30C29H291H292118.6°120.0°
C30C29N28H28168.0°174.1°
C29N28C27H28120.0°124.2°
C29N28C27C2649.7°61.7°
N28C29C30H301169.3°179.1°
N28C29C30H30270.5°60.8°
N28C29H291H292118.7°119.9°
C29N28C27H27170.3°58.3°
C29N28C27H272169.4°178.3°
N28C27C26H271120.0°120.0°
N28C27C26H272119.7°120.0°
N28C27C26H26166.3°60.7°
N28C27C26H262173.4°179.0°
C27N28C29H29172.0°58.4°
C27N28C29H292166.5°178.3°
N28C27H271H272119.7°119.9°
C27C26C25H2559.0°62.3°
C27C26H261H262119.7°120.2°
C26C27N28H28169.7°174.1°
C26C27H271H272119.7°120.0°
C3C11N18C10175.5°179.0°
C3C11N18C12176.3°178.7°
C3C11C10C14176.6°178.0°
C3C11C10C14.1°4.2°
C11N18C12N130.3°0.3°
C11N18C12N15178.1°179.6°
N18C11C10C141.0°3.0°
N18C11C10C1179.7°174.9°
C10C11N18C120.8°2.3°
C11C10C14N130.0°1.7°
C11C10C14C1179.3°177.9°
C11C10C1H11C86.8°155.3°
C11C10C1H12C151.5°86.2°
C11C10C14H14180.0°178.3°
N18C12N13N15178.0°179.9°
N18C12N13C141.3°1.1°
N18C12N15C163.8°85.2°
C12N13C14C101.1°0.3°
N13C12N15C16174.1°94.8°
C12N13C14H14178.9°179.7°
N15C12N13C14179.3°179.0°
C12N15C16C234.6°174.6°
C12N15C16C19176.7°5.1°
N13C14C10H14180.0°180.0°
N13C14C10C1179.3°176.2°
C14C10C1H11C92.6°26.9°
C14C10C1H12C29.2°91.6°
C10C1C2H21C160.5°74.6°
C10C1C2H22C79.6°165.5°
C10C1H11CH12C118.4°118.5°
C1C10C14H140.7°3.8°
N15C16C23C19178.6°179.7°
N15C16C23C22179.0°163.4°
N15C16C19C20178.3°163.1°
N15C16C23H231.0°16.5°
N15C16C19H191.6°16.5°
C16C23C22H23180.0°179.9°
C16C23C22C210.7°0.6°
C23C16C19C200.4°17.2°
C23C16C19H19179.6°163.2°
C16C23C22H22179.3°179.4°
C19C16C23C220.3°16.9°
C16C19C20C210.7°0.0°
C16C19C20H19180.0°179.7°
C19C16C23H23179.6°163.2°
C16C19C20H20179.3°179.7°
C23C22C21H22180.0°179.9°
C23C22C21C200.4°16.6°
C23C22C21H211119.6°104.3°
C23C22C21H212115.8°137.6°
C22C21C20H211120.0°120.9°
C22C21C20H212115.4°121.0°
C22C21C20C190.3°16.4°
C21C22C23H23179.2°179.3°
C22C21H211H212116.0°118.3°
C22C21C20H20179.7°163.4°
C21C20C19H20180.0°179.7°
C21C20C19H19179.3°179.6°
C20C21C22H22179.6°163.3°
C20C21H211H212116.0°118.2°
C19C20C21H211120.3°104.5°
C19C20C21H212115.0°137.3°
H21CC2C1H11C40.5°46.1°
H21CC2C1H12C81.3°164.6°
H22CC2C1H11C160.5°73.7°
H22CC2C1H12C38.7°44.7°
H171C17C25H2586.1°65.1°
H172C17C25H2536.1°174.8°
H25C25C30H30156.6°57.6°
H25C25C30H302176.9°177.7°
H25C25C26H261179.0°177.8°
H25C25C26H26260.7°57.6°
H301C30C29H29149.3°59.1°
H301C30C29H29272.1°60.9°
H302C30C29H291169.5°179.2°
H302C30C29H29248.1°59.2°
H261C26C27H271173.7°179.3°
H261C26C27H27253.4°59.3°
H262C26C27H27153.4°59.1°
H262C26C27H27266.9°60.9°
H291C29N28H2848.0°65.9°
H292C29N28H2873.4°54.1°
H28N28C27H27149.7°65.9°
H28N28C27H27270.5°54.1°
H23C23C22H220.7°0.7°
H19C19C20H200.7°0.6°
H22C22C21H21160.4°75.8°
H22C22C21H21264.3°42.4°
H211C21C20H2059.7°75.7°
H212C21C20H2064.9°42.4°

223532

PDB entries from 2024-08-07

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