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0S5

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C27C26doub1.38Å1.38ÅAromatic
C27C28sing1.38Å1.38ÅAromatic
C26C25sing1.38Å1.38ÅAromatic
C28C23doub1.40Å1.39ÅAromatic
C25C24doub1.38Å1.38ÅAromatic
C23C24sing1.40Å1.38ÅAromatic
C23C21sing1.48Å1.46Å
C16C17sing1.55Å1.52Å
C16C15sing1.55Å1.51Å
N20C21sing1.35Å1.37Å
N20C18sing1.35Å1.37Å
C17C18sing1.51Å1.51Å
C17N13sing1.47Å1.43Å
C3N2sing1.47Å1.41Å
C3C4sing1.53Å1.51Å
C21O22doub1.22Å1.22Å
O12C11doub1.21Å1.22Å
C15C14sing1.54Å1.51Å
N2O1sing1.42Å1.41Å
N2C29sing1.35Å1.35Å
C18O19doub1.21Å1.22Å
N13C11sing1.35Å1.38Å
N13C14sing1.47Å1.44Å
C11C4sing1.51Å1.49Å
C29O30doub1.21Å1.22Å
C4C5sing1.53Å1.56Å
C5C6sing1.53Å1.50Å
C6C7sing1.55Å1.48Å
C6C10sing1.55Å1.54Å
C7C8sing1.54Å1.54Å
C10C9sing1.54Å1.52Å
C8C9sing1.54Å1.52Å
C26H1sing1.08Å1.08Å
C25H2sing1.08Å1.08Å
C27H3sing1.08Å1.08Å
C24H4sing1.08Å1.08Å
C28H5sing1.08Å1.08Å
C29H6sing1.08Å1.08Å
C8H7sing1.09Å1.10Å
C8H8sing1.09Å1.10Å
C9H9sing1.09Å1.10Å
C9H10sing1.09Å1.10Å
C15H11sing1.09Å1.10Å
C16H12sing1.09Å1.10Å
C16H13sing1.09Å1.10Å
C7H14sing1.09Å1.10Å
C7H15sing1.09Å1.10Å
C10H16sing1.09Å1.10Å
C10H17sing1.09Å1.10Å
C14H18sing1.09Å1.10Å
C17H19sing1.09Å1.10Å
C6H20sing1.09Å1.10Å
C5H21sing1.09Å1.10Å
C5H22sing1.09Å1.10Å
C3H23sing1.09Å1.10Å
C3H24sing1.09Å1.10Å
C4H25sing1.09Å1.10Å
N20H26sing0.97Å1.00Å
O1H27sing0.97Å0.95Å
C15H28sing1.09Å1.10Å
C14H29sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C26C27C28120.3°120.2°
C27C26C25121.7°120.3°
C27C26H1119.1°119.8°
C26C27H3119.9°119.9°
C27C28C23116.9°119.8°
C28C27H3119.9°119.9°
C27C28H5121.6°120.1°
C26C25C24118.9°120.2°
C25C26H1119.1°119.9°
C26C25H2120.5°119.9°
C28C23C24123.7°119.7°
C28C23C21120.4°120.2°
C23C28H5121.5°120.1°
C25C24C23118.4°119.8°
C24C25H2120.5°119.9°
C25C24H4120.8°120.1°
C24C23C21115.9°120.1°
C23C24H4120.8°120.1°
C23C21N20111.9°120.0°
C23C21O22122.1°120.0°
C17C16C15105.5°101.6°
C16C17C18110.6°110.3°
C16C17N13104.7°104.8°
C17C16H12110.4°111.0°
C17C16H13110.5°111.0°
C16C17H19111.0°110.4°
C16C15C14110.2°102.9°
C16C15H11109.3°110.7°
C15C16H12110.5°111.0°
C15C16H13110.4°111.0°
C16C15H28109.3°110.9°
C21N20C18122.9°120.0°
N20C21O22125.6°120.0°
C21N20H26118.5°120.0°
N20C18C17111.9°120.0°
N20C18O19124.9°120.0°
C18N20H26118.5°120.0°
C18C17N13106.6°110.3°
C17C18O19123.2°120.0°
C18C17H19111.2°110.3°
C17N13C11118.2°125.7°
C17N13C14116.5°108.7°
N13C17H19112.4°110.5°
N2C3C4112.7°109.5°
C3N2O1119.5°120.0°
C3N2C29127.3°120.0°
N2C3H23108.7°109.5°
N2C3H24108.7°109.5°
C3C4C11101.9°109.5°
C3C4C5107.6°109.5°
C4C3H23108.7°109.5°
C4C3H24108.6°109.4°
C3C4H25110.1°109.5°
O12C11N13120.7°120.0°
O12C11C4125.9°120.0°
C15C14N13102.3°107.3°
C14C15H11109.3°110.7°
C15C14H18111.2°109.9°
C14C15H28109.3°110.7°
C15C14H29111.2°109.9°
O1N2C29112.9°120.0°
N2O1H27109.5°114.0°
N2C29O30119.8°120.0°
N2C29H6120.1°120.0°
C11N13C14122.3°125.7°
N13C11C4113.3°120.0°
N13C14H18111.2°109.9°
N13C14H29111.3°110.0°
C11C4C5116.9°109.4°
C11C4H25110.4°109.5°
O30C29H6120.1°120.0°
C4C5C6108.2°109.5°
C4C5H21109.8°109.4°
C4C5H22109.8°109.4°
C5C4H25109.5°109.5°
C5C6C7124.2°110.8°
C5C6C10116.0°110.7°
C5C6H20102.8°110.8°
C6C5H21109.8°109.5°
C6C5H22109.8°109.5°
C7C6C10105.2°102.7°
C6C7C8101.9°104.2°
C6C7H14111.4°110.5°
C6C7H15111.4°110.6°
C7C6H20103.1°110.8°
C6C10C9103.5°104.2°
C6C10H16110.9°110.5°
C6C10H17111.0°110.6°
C10C6H20102.5°110.7°
C7C8C9106.8°106.6°
C7C8H7110.1°110.0°
C7C8H8110.1°110.1°
C8C7H14111.3°110.5°
C8C7H15111.3°110.5°
C10C9C8106.3°106.6°
C10C9H9110.3°110.0°
C10C9H10110.3°110.0°
C9C10H16110.9°110.5°
C9C10H17110.9°110.5°
C9C8H7110.1°110.1°
C9C8H8110.1°110.0°
C8C9H9110.2°110.1°
C8C9H10110.3°110.0°
H7C8H8109.5°110.0°
H9C9H10109.5°110.0°
H11C15H28109.5°110.7°
H12C16H13109.4°110.9°
H14C7H15109.5°110.4°
H16C10H17109.5°110.5°
H18C14H29109.5°109.9°
H21C5H22109.5°109.5°
H23C3H24109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C26C27C28H3180.0°180.0°
C27C26C25H1180.0°179.8°
C26C27C28C230.9°0.5°
C27C26C25C240.7°0.2°
C27C26C25H2179.3°179.7°
C26C27C28H5179.1°180.0°
C28C27C26C250.6°0.0°
C27C28C23H5180.0°179.5°
C27C28C23C240.1°0.8°
C27C28C23C21179.6°180.0°
C28C27C26H1179.4°179.8°
C26C25C24H2180.0°179.9°
C26C25C24C231.6°0.1°
C25C26C27H3179.4°180.0°
C26C25C24H4178.4°180.0°
C28C23C24C251.3°0.6°
C28C23C24C21179.7°179.2°
C28C23C21N2037.7°180.0°
C28C23C21O22149.0°0.0°
C23C28C27H3179.1°179.5°
C28C23C24H4178.7°179.5°
C25C24C23H4180.0°179.9°
C25C24C23C21178.3°179.8°
C24C25C26H1179.3°180.0°
C24C23C21N20141.9°0.8°
C24C23C21O2231.4°179.2°
C23C24C25H2178.4°180.0°
C24C23C28H5179.9°179.7°
C23C21N20O22173.0°180.0°
C23C21N20C18173.0°180.0°
C21C23C24H41.6°0.3°
C21C23C28H50.4°0.5°
C23C21N20H267.1°0.1°
C17C16C15H12119.4°118.1°
C17C16C15H13119.4°118.1°
C16C17C18N20109.4°91.8°
C16C17C18N13113.3°115.4°
C16C17C18H19123.9°122.2°
C16C17N13H19120.6°118.9°
C17C16C15C144.1°35.5°
C16C17C18O1972.4°88.3°
C16C17N13C11170.8°155.9°
C16C17N13C1410.0°24.2°
C17C16C15H11124.2°153.8°
C17C16H12H13121.8°123.9°
C17C16C15H28116.0°82.9°
C15C16C17C18122.5°155.9°
C15C16C17N138.0°37.1°
C16C15C14H11120.1°118.3°
C16C15C14H28120.1°118.6°
C16C15C14N131.4°22.2°
C16C15H11H28119.7°123.4°
C15C16H12H13121.8°123.9°
C16C15C14H18120.2°97.2°
C15C16C17H19113.5°81.9°
C16C15C14H29117.4°141.8°
C21N20C18H26180.0°180.0°
C21N20C18C17176.3°180.0°
C21N20C18O191.8°0.0°
N20C18C17O19178.2°180.0°
N20C18C17N13137.2°152.9°
C18N20C21O2214.0°0.0°
N20C18C17H1914.4°30.5°
C18C17N13H19122.1°122.3°
C18C17N13C1172.0°37.1°
C18C17N13C14127.3°143.0°
C18C17C16H123.1°86.1°
C18C17C16H13118.1°37.7°
C17C18N20H263.6°0.0°
C17N13C11O128.1°5.4°
C17N13C14C157.3°1.1°
N13C17C18O1940.9°27.1°
C17N13C11C14159.6°180.0°
C17N13C11C4168.5°174.7°
N13C17C16H12111.4°155.1°
N13C17C16H13127.4°81.1°
C17N13C14H18126.1°120.5°
C17N13C14H29111.5°118.4°
N2C3C4H23120.5°120.0°
N2C3C4H24120.5°120.0°
C3N2O1C29174.0°179.9°
N2C3C4C11174.3°54.1°
C3N2C29O30178.9°180.0°
N2C3C4C562.2°65.9°
C3N2C29H61.1°0.0°
N2C3H23H24118.6°120.0°
N2C3C4H2557.1°174.1°
C3N2O1H27176.6°180.0°
C3C4C11O1269.8°97.6°
C4C3N2O177.9°100.4°
C4C3N2C2995.2°79.7°
C3C4C11N13106.6°82.5°
C3C4C11C5117.0°120.0°
C3C4C11H25117.0°120.0°
C3C4C5H25119.7°120.0°
C3C4C5C6177.7°63.8°
C3C4C5H2157.9°176.2°
C3C4C5H2262.5°56.2°
C4C3H23H24118.5°120.0°
O22C21N20H26166.0°180.0°
O12C11N13C4176.6°179.9°
O12C11N13C14167.6°174.6°
O12C11C4C547.1°22.4°
O12C11C4H25173.2°142.4°
C15C14N13C11167.2°178.9°
C15C14N13H18118.8°119.4°
C15C14N13H29118.8°119.5°
C14C15H11H28119.7°123.1°
C14C15C16H12115.3°153.6°
C14C15C16H13123.5°82.6°
C15C14H18H29123.3°121.0°
O1N2C29O305.4°0.1°
O1N2C29H6174.6°179.9°
O1N2C3H23161.6°139.5°
O1N2C3H2442.6°19.5°
N2C29O30H6180.0°180.0°
C29N2C3H2325.3°40.4°
C29N2C3H24144.4°160.4°
C29N2O1H272.6°0.1°
O19C18C17H19163.7°149.5°
O19C18N20H26178.2°180.0°
N13C11C4C5136.5°157.5°
C11N13C14H1874.0°59.5°
C11N13C17H1950.1°85.2°
N13C11C4H2510.4°37.6°
C11N13C14H2948.3°61.6°
C14N13C11C49.0°5.3°
N13C14C15H11118.7°140.5°
N13C14H18H29123.4°121.1°
C14N13C17H19110.6°94.7°
N13C14C15H28121.5°96.4°
C11C4C5H25126.5°120.0°
C11C4C5C668.4°176.2°
C11C4C5H21171.8°56.2°
C11C4C5H2251.4°63.8°
C11C4C3H2365.2°174.1°
C11C4C3H2453.8°65.9°
C4C5C6H21119.8°120.0°
C4C5C6H22119.8°120.0°
C4C5C6C745.7°173.3°
C4C5C6C10178.9°73.4°
C4C5C6H2070.1°49.9°
C4C5H21H22120.6°119.9°
C5C4C3H2358.3°54.1°
C5C4C3H24177.3°174.1°
C5C6C7C10137.2°118.3°
C5C6C7H20115.7°123.4°
C5C6C10H20111.2°123.4°
C5C6C7C8177.6°156.2°
C5C6C10C9177.4°156.2°
C5C6C7H1463.6°37.5°
C5C6C7H1558.9°85.0°
C5C6C10H1658.4°85.1°
C5C6C10H1763.5°37.6°
C6C5H21H22120.6°120.1°
C6C5C4H2558.1°56.3°
C7C6C10H20107.5°118.3°
C6C7C8H14118.8°118.7°
C6C7C8H15118.8°118.8°
C7C6C10C936.1°37.9°
C6C7C8C930.0°23.6°
C6C7C8H789.6°142.9°
C6C7C8H8149.6°95.7°
C6C7H14H15123.6°122.7°
C7C6C10H1682.9°156.6°
C7C6C10H17155.2°80.7°
C7C6C5H2174.1°66.8°
C7C6C5H22165.5°53.3°
C10C6C7C840.4°37.9°
C6C10C9H16119.0°118.7°
C6C10C9H17119.1°118.8°
C6C10C9C816.3°23.6°
C6C10C9H9135.8°95.7°
C6C10C9H10103.2°142.9°
C10C6C7H14159.2°80.8°
C10C6C7H1578.3°156.7°
C6C10H16H17122.8°122.7°
C10C6C5H2159.1°46.6°
C10C6C5H2261.3°166.6°
C7C8C9C108.0°0.0°
C7C8C9H7119.6°119.3°
C7C8C9H8119.6°119.3°
C7C8H7H8121.2°121.4°
C7C8C9H9111.5°119.3°
C7C8C9H10127.5°119.3°
C8C7H14H15123.5°122.6°
C8C7C6H2066.7°80.4°
C10C9C8H9119.5°119.3°
C10C9C8H10119.5°119.3°
C10C9C8H7111.6°119.3°
C10C9C8H8127.6°119.3°
C10C9H9H10121.5°121.4°
C9C10H16H17122.7°122.5°
C9C10C6H2071.4°80.4°
C9C8H7H8121.2°121.4°
C8C9H9H10121.5°121.4°
C9C8C7H14148.8°95.1°
C9C8C7H1588.8°142.4°
C8C9C10H16102.8°142.3°
C8C9C10H17135.3°95.2°
H1C26C25H20.7°0.1°
H1C26C27H30.6°0.2°
H2C25C24H41.6°0.1°
H3C27C28H50.9°0.0°
H7C8C9H9128.9°121.5°
H7C8C9H107.9°0.1°
H7C8C7H1429.2°24.2°
H7C8C7H15151.7°98.3°
H8C8C9H98.1°0.1°
H8C8C9H10112.9°121.3°
H8C8C7H1491.6°145.6°
H8C8C7H1530.8°23.1°
H9C9C10H1616.7°23.0°
H9C9C10H17105.2°145.5°
H10C9C10H16137.7°98.4°
H10C9C10H1715.8°24.2°
H11C15C16H124.8°88.1°
H11C15C16H13116.4°35.7°
H11C15C14H180.1°21.1°
H11C15C14H29122.5°99.9°
H12C16C17H19127.1°36.1°
H12C16C15H28124.7°35.2°
H13C16C17H195.9°159.9°
H13C16C15H283.4°159.0°
H14C7C6H2052.1°161.0°
H15C7C6H20174.6°38.4°
H16C10C6H20169.6°38.3°
H17C10C6H2047.7°160.9°
H18C14C15H28119.7°144.2°
H20C6C5H21170.1°169.9°
H20C6C5H2249.7°70.1°
H21C5C4H2561.7°63.8°
H22C5C4H25177.9°176.3°
H23C3C4H25177.5°65.9°
H24C3C4H2563.4°54.1°
H28C15C14H292.7°23.2°

222415

PDB entries from 2024-07-10

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