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AI8

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N8C18sing1.38Å1.45Å
S4C18sing1.72Å1.66ÅAromatic
S4N7sing1.70Å1.55ÅAromatic
C18N6doub1.31Å1.35ÅAromatic
N7C14doub1.31Å1.32ÅAromatic
N6C14sing1.32Å1.37ÅAromatic
O3C6doub1.21Å1.21Å
C14C12sing1.48Å1.49Å
C6C5sing1.51Å1.52Å
C12N4doub1.30Å1.24Å
C12C11sing1.48Å1.54Å
O4C10doub1.22Å1.25Å
N3C11sing1.35Å1.45Å
N3C5sing1.47Å1.46Å
O7N4sing1.42Å1.30Å
O7C21sing1.43Å1.37Å
C11O6doub1.22Å1.17Å
C10O5sing1.35Å1.27Å
C10C7sing1.42Å1.52Å
C5C4sing1.53Å1.62Å
N2C7sing1.40Å1.47Å
N2C4sing1.47Å1.60Å
C7C9doub1.33Å1.46Å
C24C21sing1.53Å1.47Å
C9S2sing1.76Å1.80Å
C9C8sing1.50Å1.55Å
S2C13sing1.76Å1.82Å
C8S1sing1.82Å1.75Å
C4S1sing1.82Å1.48Å
C13N5doub1.30Å1.37ÅAromatic
C13S3sing1.76Å1.73ÅAromatic
N5C15sing1.33Å1.38ÅAromatic
C19C22doub1.38Å1.37ÅAromatic
C19C17sing1.40Å1.42ÅAromatic
S3C16sing1.76Å1.71ÅAromatic
C22N9sing1.32Å1.36ÅAromatic
C15C17sing1.48Å1.55Å
C15C16doub1.35Å1.43ÅAromatic
C17C20doub1.40Å1.41ÅAromatic
N9C25sing1.46Å1.44Å
N9C23doub1.32Å1.36ÅAromatic
C20C23sing1.38Å1.38ÅAromatic
N2HN2sing0.97Å1.00Å
N3HN3sing0.97Å1.00Å
C4H4sing1.09Å1.10Å
C5H5sing1.09Å1.10Å
C6H6sing1.08Å1.08Å
C8H18sing1.09Å1.10Å
C8H28sing1.09Å1.10Å
N8H1N8sing0.97Å1.00Å
N8H2N8sing0.97Å1.00Å
C16H16sing1.08Å1.08Å
C19H19sing1.08Å1.08Å
C20H20sing1.08Å1.08Å
C21H121sing1.09Å1.10Å
C21H221sing1.09Å1.10Å
C22H22sing1.08Å1.08Å
C23H23sing1.08Å1.08Å
C24H124sing1.09Å1.10Å
C24H224sing1.09Å1.10Å
C24H324sing1.09Å1.10Å
C25H125sing1.09Å1.10Å
C25H225sing1.09Å1.10Å
C25H325sing1.09Å1.10Å
O5HO5sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N8C18S4126.3°127.4°
N8C18N6129.2°127.4°
C18N8H1N8109.5°120.0°
C18N8H2N8109.5°120.0°
C18S4N7100.5°94.7°
S4C18N6104.4°105.3°
S4N7C14106.6°105.8°
C18N6C14112.2°116.8°
N7C14N6116.3°117.5°
N7C14C12118.9°121.3°
N6C14C12124.6°121.3°
O3C6C5120.0°120.0°
O3C6H6120.0°120.0°
C14C12N4122.3°120.0°
C14C12C11112.3°120.0°
C6C5N3107.8°109.5°
C6C5C4114.7°109.5°
C6C5H5106.6°109.5°
C5C6H6120.0°120.0°
N4C12C11125.4°120.0°
C12N4O7123.9°120.0°
C12C11N3124.3°120.0°
C12C11O6116.1°120.0°
O4C10O5140.1°120.0°
O4C10C7110.2°120.0°
C11N3C5119.3°120.0°
N3C11O6119.6°120.0°
C11N3HN3120.4°120.0°
N3C5C4114.1°109.4°
C5N3HN3120.4°120.0°
N3C5H5107.4°109.5°
N4O7C21121.1°114.0°
O7C21C24115.6°109.5°
O7C21H121107.9°109.5°
O7C21H221107.9°109.5°
O5C10C7109.7°120.0°
C10O5HO5109.5°114.0°
C10C7N2121.1°116.6°
C10C7C9120.0°116.6°
C5C4N2107.5°109.9°
C5C4S1110.1°109.9°
C5C4H4107.1°109.9°
C4C5H5105.6°109.5°
C7N2C4119.8°120.8°
N2C7C9119.0°126.8°
C7N2HN2106.9°119.6°
N2C4S1115.5°107.3°
C4N2HN2106.8°119.6°
N2C4H4107.4°109.9°
C7C9S2129.0°117.2°
C7C9C8121.1°125.5°
C24C21H121107.9°109.5°
C24C21H221107.9°109.5°
C21C24H124109.5°109.5°
C21C24H224109.4°109.5°
C21C24H324109.5°109.5°
S2C9C8110.0°117.3°
C9S2C13101.4°100.0°
C9C8S1105.3°109.5°
C9C8H18110.5°109.5°
C9C8H28110.5°109.4°
S2C13N5129.7°125.3°
S2C13S3121.5°125.3°
C8S1C4110.3°101.4°
S1C8H18110.5°109.5°
S1C8H28110.5°109.5°
S1C4H4108.9°109.9°
N5C13S3108.7°109.4°
C13N5C15114.8°117.1°
C13S3C1695.3°90.0°
N5C15C17122.4°122.3°
N5C15C16114.3°115.3°
C22C19C17120.1°119.1°
C19C22N9119.8°120.9°
C22C19H19119.9°120.5°
C19C22H22120.1°119.6°
C19C17C15117.0°121.0°
C19C17C20119.3°118.1°
C17C19H19119.9°120.4°
S3C16C15106.8°108.3°
S3C16H16126.5°125.9°
C22N9C25119.1°119.0°
C22N9C23121.1°122.0°
N9C22H22120.1°119.5°
C17C15C16123.0°122.4°
C15C17C20123.5°120.9°
C15C16H16126.6°125.9°
C17C20C23117.4°119.0°
C17C20H20121.3°120.6°
C25N9C23119.8°119.0°
N9C25H125109.5°109.5°
N9C25H225109.5°109.5°
N9C25H325109.5°109.5°
N9C23C20122.2°120.9°
N9C23H23118.9°119.6°
C23C20H20121.3°120.5°
C20C23H23118.9°119.5°
H18C8H28109.4°109.4°
H1N8N8H2N8109.5°120.0°
H121C21H221109.5°109.5°
H124C24H224109.5°109.5°
H124C24H324109.5°109.4°
H224C24H324109.5°109.5°
H125C25H225109.4°109.5°
H125C25H325109.5°109.5°
H225C25H325109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N8C18S4N6180.0°180.0°
N8C18S4N7180.0°180.0°
N8C18N6C14179.7°180.0°
C18N8H1N8H2N8120.0°180.0°
C18S4N7C140.3°0.0°
S4C18N6C140.3°0.0°
S4C18N8H1N80.0°0.0°
S4C18N8H2N8120.0°180.0°
N7S4C18N60.0°0.0°
S4N7C14N60.5°0.0°
S4N7C14C12175.0°180.0°
C18N6C14N70.6°0.0°
C18N6C14C12174.7°180.0°
N6C18N8H1N8180.0°180.0°
N6C18N8H2N860.0°0.0°
N7C14N6C12175.3°180.0°
N7C14C12N43.7°174.0°
N7C14C12C11177.9°6.0°
N6C14C12N4171.4°6.0°
N6C14C12C116.9°174.0°
O3C6C5H6180.0°180.0°
O3C6C5N325.2°0.0°
O3C6C5C4103.1°119.9°
O3C6C5H5140.3°120.0°
C14C12N4C11178.2°180.0°
C14C12C11N3107.2°6.2°
C14C12N4O7113.3°174.9°
C14C12C11O675.3°174.0°
C6C5N3C11109.9°85.1°
C6C5N3C4128.7°120.0°
C6C5N3H5114.6°120.0°
C6C5C4H5117.1°120.0°
C6C5C4N231.3°60.0°
C6C5C4S1157.8°57.8°
C6C5N3HN370.1°95.0°
C6C5C4H483.9°178.9°
N4C12C11N374.4°173.9°
C12N4O7C21150.5°180.0°
N4C12C11O6103.0°6.0°
C12C11N3O6177.3°179.9°
C12C11N3C5179.0°174.8°
C11C12N4O768.6°5.1°
C12C11N3HN31.0°5.1°
O4C10O5C7180.0°180.0°
O4C10C7N2154.5°173.6°
O4C10C7C924.2°6.3°
O4C10O5HO50.0°5.0°
C11N3C5HN3180.0°179.9°
C11N3C5C4121.4°155.0°
C11N3C5H54.7°34.9°
C5N3C11O61.6°5.3°
N3C5C4H5117.8°120.0°
N3C5C4N293.9°180.0°
N3C5C4S132.7°62.2°
N3C5C4H4151.0°58.9°
N3C5C6H6154.8°180.0°
N4O7C21C24177.9°180.0°
N4O7C21H12157.0°60.0°
N4O7C21H22161.2°60.0°
O7C21C24H121120.9°120.0°
O7C21C24H221120.9°120.0°
O7C21H121H221117.2°120.0°
O7C21C24H124180.0°60.0°
O7C21C24H22460.0°60.0°
O7C21C24H32460.0°180.0°
O6C11N3HN3178.3°174.8°
O5C10C7N225.5°6.4°
O5C10C7C9155.8°173.7°
C10C7N2C9178.7°179.9°
C10C7N2C4154.9°164.9°
C10C7C9S20.9°1.3°
C10C7C9C8179.9°178.7°
C10C7N2HN233.4°15.1°
C7C10O5HO5180.0°175.1°
C5C4N2C7125.3°164.6°
C5C4N2S1123.3°119.5°
C5C4N2H4115.0°121.1°
C5C4S1C882.1°176.2°
C5C4S1H4117.2°121.1°
C5C4N2HN2113.2°15.5°
C4C5N3HN358.6°25.0°
C4C5C6H676.9°60.0°
C7N2C4HN2121.5°180.0°
N2C7C9S2179.6°178.6°
N2C7C9C81.4°1.4°
C7N2C4S12.0°45.1°
C7N2C4H4119.7°74.4°
C4N2C7C926.5°15.2°
N2C4S1C839.8°56.8°
N2C4S1H4120.9°119.5°
N2C4C5H5148.4°60.0°
C7C9S2C8179.1°180.0°
C7C9S2C1362.0°112.9°
C7C9C8S138.7°21.7°
C9C7N2HN2147.9°164.8°
C7C9C8H1880.6°98.3°
C7C9C8H28158.1°141.8°
C24C21H121H221117.2°120.0°
C21C24H124H224120.0°120.0°
C21C24H124H324120.0°120.1°
C21C24H224H324120.0°120.1°
S2C9C8S1140.5°158.3°
C9S2C13N5159.8°175.5°
C9S2C13S315.5°4.4°
S2C9C8H18100.2°81.7°
S2C9C8H2821.1°38.2°
C8C9S2C13117.1°67.1°
C9C8S1H18119.4°120.0°
C9C8S1H28119.4°120.0°
C9C8S1C459.2°45.6°
C9C8H18H28122.0°119.9°
S2C13N5S3175.8°180.0°
S2C13N5C15177.6°180.0°
S2C13S3C16176.5°180.0°
C8S1C4H4160.7°62.7°
S1C8H18H28121.9°120.0°
S1C4N2HN2123.5°134.9°
S1C4C5H585.1°177.8°
C4S1C8H1860.1°74.4°
C4S1C8H28178.6°165.7°
N5C13S3C160.3°0.0°
C13N5C15C17177.0°180.0°
C13N5C15C162.9°0.0°
S3C13N5C151.8°0.0°
C13S3C16C151.2°0.0°
C13S3C16H16178.8°180.0°
N5C15C17C1934.3°179.8°
N5C15C16S32.5°0.0°
N5C15C17C16173.6°180.0°
N5C15C17C20150.8°0.1°
N5C15C16H16177.5°180.0°
C22C19C17H19180.0°180.0°
C19C22N9H22180.0°180.0°
C22C19C17C15177.2°180.0°
C22C19C17C202.0°0.3°
C19C22N9C25179.3°180.0°
C19C22N9C230.7°0.3°
C17C19C22N91.0°0.0°
C19C17C15C20174.9°179.7°
C19C17C15C16139.3°0.2°
C19C17C20C232.7°0.3°
C19C17C20H20177.3°180.0°
C17C19C22H22179.0°180.0°
S3C16C15C17176.6°180.0°
S3C16C15H16180.0°180.0°
C22N9C25C23178.6°179.7°
C22N9C23C201.5°0.3°
N9C22C19H19179.0°180.0°
C22N9C23H23178.5°179.7°
C22N9C25H125180.0°89.7°
C22N9C25H22560.0°30.3°
C22N9C25H32560.0°150.2°
C15C17C20C23177.6°180.0°
C17C15C16H163.4°0.0°
C15C17C19H192.8°0.0°
C15C17C20H202.5°0.3°
C16C15C17C2035.6°179.9°
C17C20C23N92.5°0.0°
C17C20C23H20180.0°179.6°
C20C17C19H19178.0°179.7°
C17C20C23H23177.5°180.0°
C25N9C23C20179.9°179.9°
C25N9C22H220.7°0.0°
C25N9C23H230.1°0.1°
N9C25H125H225120.0°120.0°
N9C25H125H325120.0°120.1°
N9C25H225H325120.0°120.0°
N9C23C20H23180.0°180.0°
N9C23C20H20177.5°179.7°
C23N9C22H22179.3°179.7°
C23N9C25H1251.4°90.0°
C23N9C25H225118.6°150.0°
C23N9C25H325121.4°30.1°
HN2N2C4H41.8°105.6°
HN3N3C5H5175.3°145.0°
H4C4C5H533.2°61.1°
H5C5C6H639.7°60.0°
H19C19C22H221.0°0.0°
H20C20C23H232.5°0.3°
H121C21C24H12459.1°180.0°
H121C21C24H224179.1°60.0°
H121C21C24H32460.9°60.0°
H221C21C24H12459.1°60.0°
H221C21C24H22460.9°180.0°
H221C21C24H324179.1°60.0°
H124C24H224H324120.0°119.9°
H125C25H225H325120.0°120.0°

225946

PDB entries from 2024-10-09

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