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8H5

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O7C27sing1.43Å1.42Å
O7C15sing1.36Å1.36Å
C14C15doub1.39Å1.38ÅAromatic
C14C13sing1.37Å1.37ÅAromatic
C15C16sing1.39Å1.38ÅAromatic
C13C12doub1.40Å1.40ÅAromatic
C16C17doub1.39Å1.40ÅAromatic
C12C17sing1.42Å1.39ÅAromatic
C12C11sing1.44Å1.43ÅAromatic
C17N1sing1.38Å1.39ÅAromatic
C25C24sing1.53Å1.52Å
O6C10sing1.43Å1.41Å
C11C10sing1.51Å1.49Å
C11C1doub1.34Å1.35ÅAromatic
O2C24sing1.41Å1.46Å
O2O1sing1.47Å1.48Å
N1C18sing1.47Å1.46Å
N1C1sing1.36Å1.39ÅAromatic
C22C20sing1.51Å1.50Å
C10C9sing1.54Å1.54Å
C18O1sing1.39Å1.41Å
C18C19sing1.51Å1.49Å
C1C2sing1.53Å1.49Å
C24C23sing1.55Å1.52Å
C24C26sing1.53Å1.51Å
C23C2sing1.57Å1.55Å
C20C19doub1.31Å1.32Å
C20C21sing1.51Å1.49Å
O4C8doub1.21Å1.23Å
C2N2sing1.49Å1.50Å
C9C8sing1.50Å1.53Å
C9N2sing1.45Å1.47Å
C9O5sing1.43Å1.40Å
C8N3sing1.33Å1.31Å
N2C3sing1.35Å1.37Å
N3C7sing1.47Å1.47Å
N3C4sing1.48Å1.46Å
C3O3doub1.21Å1.22Å
C3C4sing1.49Å1.50Å
C7C6sing1.55Å1.51Å
C4C5sing1.54Å1.52Å
C5C6sing1.55Å1.52Å
C10H1sing1.09Å1.10Å
C13H2sing1.08Å1.08Å
C14H3sing1.08Å1.08Å
C16H4sing1.08Å1.08Å
C18H5sing1.09Å1.10Å
C19H6sing1.08Å1.08Å
C2H7sing1.09Å1.10Å
C21H8sing1.09Å1.10Å
C21H9sing1.09Å1.10Å
C21H10sing1.09Å1.10Å
C22H11sing1.09Å1.10Å
C22H12sing1.09Å1.10Å
C22H13sing1.09Å1.10Å
C23H14sing1.09Å1.10Å
C23H15sing1.09Å1.10Å
C25H16sing1.09Å1.10Å
C25H17sing1.09Å1.10Å
C25H18sing1.09Å1.10Å
C26H19sing1.09Å1.10Å
C26H20sing1.09Å1.10Å
C26H21sing1.09Å1.10Å
C27H22sing1.09Å1.10Å
C27H23sing1.09Å1.10Å
C27H24sing1.09Å1.10Å
C4H25sing1.09Å1.10Å
C5H26sing1.09Å1.10Å
C5H27sing1.09Å1.10Å
C6H28sing1.09Å1.10Å
C6H29sing1.09Å1.10Å
C7H30sing1.09Å1.10Å
C7H31sing1.09Å1.10Å
O5H32sing0.97Å0.95Å
O6H33sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C27O7C15118.2°117.0°
O7C27H22109.5°109.5°
O7C27H23109.5°109.5°
O7C27H24109.5°109.5°
O7C15C14115.3°119.0°
O7C15C16123.8°119.0°
C15C14C13122.0°122.1°
C14C15C16120.9°122.0°
C15C14H3119.0°118.9°
C14C13C12119.0°117.0°
C14C13H2120.5°121.5°
C13C14H3119.0°119.0°
C15C16C17116.9°117.0°
C15C16H4121.6°121.5°
C13C12C17118.1°121.2°
C13C12C11135.7°133.3°
C12C13H2120.5°121.5°
C16C17C12123.1°120.7°
C16C17N1127.8°131.6°
C17C16H4121.5°121.5°
C17C12C11106.2°105.5°
C12C17N1109.1°107.7°
C12C11C10131.6°131.6°
C12C11C1107.8°106.4°
C17N1C18120.9°124.3°
C17N1C1107.0°107.7°
C25C24O2100.9°108.7°
C25C24C23109.5°108.8°
C25C24C26111.2°108.7°
C24C25H16109.5°109.5°
C24C25H17109.5°109.5°
C24C25H18109.4°109.5°
O6C10C11109.2°110.3°
O6C10C9111.5°110.2°
O6C10H1109.5°110.2°
C10O6H33109.5°114.0°
C10C11C1120.6°122.0°
C11C10C9110.3°105.7°
C11C10H1108.4°110.2°
C11C1N1109.9°111.4°
C11C1C2123.8°125.2°
C24O2O1108.3°114.1°
O2C24C23112.0°112.9°
O2C24C26110.2°108.8°
O2O1C18106.5°117.1°
C18N1C1132.1°128.0°
N1C18O1113.2°112.6°
N1C18C19113.3°108.9°
N1C18H5107.8°108.7°
N1C1C2126.3°123.1°
C22C20C19124.1°120.0°
C22C20C21114.4°120.0°
C20C22H11109.5°109.5°
C20C22H12109.5°109.5°
C20C22H13109.5°109.5°
C10C9C8108.9°108.1°
C10C9N2111.3°110.0°
C10C9O5111.9°108.8°
C9C10H1107.8°110.2°
O1C18C19106.4°108.9°
O1C18H5108.5°108.9°
C18C19C20125.1°120.0°
C19C18H5107.4°108.8°
C18C19H6117.5°119.9°
C1C2C23109.7°105.2°
C1C2N2109.4°108.0°
C1C2H7109.2°112.8°
C23C24C26112.5°108.8°
C24C23C2118.0°106.8°
C24C23H14107.3°110.0°
C24C23H15107.3°110.0°
C24C26H19109.5°109.5°
C24C26H20109.5°109.5°
C24C26H21109.5°109.4°
C23C2N2110.9°103.3°
C23C2H7108.5°113.8°
C2C23H14107.3°110.0°
C2C23H15107.3°110.0°
C19C20C21121.5°120.0°
C20C19H6117.4°120.0°
C20C21H8109.5°109.5°
C20C21H9109.5°109.5°
C20C21H10109.4°109.5°
O4C8C9119.6°119.3°
O4C8N3122.6°119.3°
C2N2C9124.7°121.1°
C2N2C3114.5°115.5°
N2C2H7109.1°113.0°
C8C9N2110.5°113.1°
C8C9O5103.0°108.7°
C9C8N3117.8°121.3°
N2C9O5111.0°108.1°
C9N2C3120.8°123.5°
C9O5H32109.5°114.0°
C8N3C7125.0°129.6°
C8N3C4123.3°125.4°
N2C3O3123.3°117.8°
N2C3C4117.8°124.4°
C7N3C4111.6°105.0°
N3C7C6103.9°104.4°
N3C7H30110.8°110.4°
N3C7H31110.9°110.5°
N3C4C3113.0°109.5°
N3C4C5102.1°104.5°
N3C4H25108.9°110.8°
O3C3C4118.9°117.8°
C3C4C5116.0°111.3°
C3C4H25108.4°110.3°
C7C6C5104.6°105.0°
C7C6H28110.7°110.4°
C7C6H29110.7°110.4°
C6C7H30110.9°110.5°
C6C7H31110.9°110.5°
C4C5C6102.6°104.8°
C5C4H25108.2°110.3°
C4C5H26111.1°110.4°
C4C5H27111.2°110.3°
C6C5H26111.2°110.4°
C6C5H27111.1°110.4°
C5C6H28110.6°110.3°
C5C6H29110.7°110.3°
H8C21H9109.5°109.4°
H8C21H10109.4°109.5°
H9C21H10109.5°109.5°
H11C22H12109.5°109.5°
H11C22H13109.5°109.4°
H12C22H13109.5°109.5°
H14C23H15109.5°109.9°
H16C25H17109.5°109.5°
H16C25H18109.5°109.4°
H17C25H18109.4°109.4°
H19C26H20109.4°109.5°
H19C26H21109.4°109.5°
H20C26H21109.5°109.4°
H22C27H23109.5°109.5°
H22C27H24109.5°109.5°
H23C27H24109.4°109.4°
H26C5H27109.5°110.4°
H28C6H29109.5°110.3°
H30C7H31109.5°110.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C27O7C15C14169.1°0.0°
C27O7C15C1610.7°179.9°
O7C27H22H23120.0°120.0°
O7C27H22H24120.0°120.0°
O7C27H23H24120.0°120.0°
O7C15C14C16179.8°179.9°
O7C15C14C13180.0°179.9°
O7C15C16C17179.9°179.9°
O7C15C14H30.0°0.2°
O7C15C16H40.1°0.2°
C15O7C27H22180.0°60.0°
C15O7C27H2360.0°60.0°
C15O7C27H2460.0°179.9°
C15C14C13H3180.0°179.9°
C15C14C13C120.1°0.3°
C14C15C16C170.1°0.0°
C15C14C13H2179.9°179.8°
C14C15C16H4179.9°179.9°
C13C14C15C160.2°0.0°
C14C13C12H2180.0°180.0°
C14C13C12C170.0°0.4°
C14C13C12C11179.8°179.2°
C15C16C17H4180.0°180.0°
C15C16C17C120.0°0.1°
C15C16C17N1179.9°179.8°
C16C15C14H3179.8°180.0°
C13C12C17C160.0°0.3°
C13C12C17C11179.9°179.7°
C13C12C17N1180.0°179.6°
C13C12C11C100.4°6.1°
C13C12C11C1179.9°173.4°
C12C13C14H3179.9°179.8°
C16C17C12N1179.9°180.0°
C16C17C12C11179.9°179.3°
C16C17N1C180.1°7.8°
C16C17N1C1179.9°172.7°
C17C12C11C10179.7°174.3°
C17C12C11C10.1°6.2°
C12C17N1C18179.8°172.1°
C12C17N1C10.2°7.3°
C17C12C13H2180.0°179.6°
C12C17C16H4180.0°179.9°
C11C12C17N10.2°0.7°
C12C11C10O619.5°30.4°
C12C11C10C1179.6°179.4°
C12C11C1N10.0°11.3°
C12C11C10C9142.4°149.5°
C12C11C1C2179.8°174.6°
C12C11C10H199.7°91.5°
C11C12C13H20.2°0.8°
C17N1C1C110.1°11.9°
C17N1C18C1180.0°179.4°
C17N1C18O1156.3°100.1°
C17N1C18C1982.5°139.1°
C17N1C1C2179.9°173.9°
N1C17C16H40.1°0.1°
C17N1C18H536.3°20.7°
C25C24O2C23116.4°120.8°
C25C24O2C26117.6°118.3°
C25C24O2O1160.4°2.4°
C25C24C23C26124.2°118.3°
C25C24C23C2162.2°62.9°
C25C24C23H1441.0°177.7°
C25C24C23H1576.6°56.5°
C24C25H16H17120.0°120.1°
C24C25H16H18120.0°120.0°
C24C25H17H18120.0°120.0°
C25C24C26H19180.0°58.3°
C25C24C26H2060.0°61.7°
C25C24C26H2160.0°178.3°
O6C10C11C9122.9°119.1°
O6C10C11H1119.3°121.9°
O6C10C11C1160.9°150.2°
O6C10C9H1120.3°121.7°
O6C10C9C869.7°59.9°
O6C10C9N2168.3°176.2°
O6C10C9O543.5°58.0°
C10C11C1N1179.7°169.2°
C11C10C9H1118.2°119.1°
C10C11C1C20.1°4.9°
C11C10C9C8168.8°179.1°
C11C10C9N246.8°57.0°
C11C10C9O578.0°61.2°
C11C10O6H33173.0°63.7°
C11C1N1C18179.9°167.6°
C11C1N1C2179.8°174.2°
C1C11C10C938.0°31.1°
C11C1C2C2396.6°95.7°
C11C1C2N225.2°14.1°
C1C11C10H179.8°87.9°
C11C1C2H7144.6°139.7°
C24O2O1C18134.1°73.1°
O2C24C23C26124.8°120.9°
O2C24C23C251.1°57.8°
O2C24C23H1470.1°61.5°
O2C24C23H15172.4°177.2°
O2C24C25H16180.0°126.1°
O2C24C25H1760.0°6.1°
O2C24C25H1860.0°113.9°
O2C24C26H1969.0°176.6°
O2C24C26H20171.0°56.5°
O2C24C26H2151.0°63.4°
O2O1C18N156.0°63.2°
O2O1C18C19178.9°57.7°
O1O2C24C2383.2°118.4°
O1O2C24C2642.8°120.6°
O2O1C18H563.6°176.2°
N1C18O1C19125.1°120.8°
N1C18O1H5119.6°120.7°
N1C18C19H5119.0°118.3°
C18N1C1C20.1°6.7°
N1C18C19C20148.6°96.1°
N1C18C19H631.4°83.8°
C1N1C18O123.7°80.6°
C1N1C18C1997.5°40.3°
N1C1C2C2383.2°90.8°
N1C1C2N2155.0°159.3°
C1N1C18H5143.7°158.7°
N1C1C2H735.6°33.7°
C22C20C19C180.4°174.2°
C22C20C19C21179.7°180.0°
C22C20C19H6179.6°5.8°
C22C20C21H8180.0°85.8°
C22C20C21H960.0°34.2°
C22C20C21H1060.0°154.2°
C20C22H11H12120.0°120.0°
C20C22H11H13120.0°120.0°
C20C22H12H13120.0°120.0°
C10C9C8O424.2°60.7°
C10C9N2C223.5°54.1°
C10C9C8N2122.5°122.0°
C10C9C8O5118.9°117.9°
C10C9N2O5125.3°118.6°
C10C9C8N3155.9°119.3°
C10C9N2C3158.6°126.2°
C10C9O5H32180.0°60.0°
C9C10O6H3350.9°180.0°
O1C18C19H5116.0°118.5°
O1C18C19C2086.4°140.7°
O1C18C19H693.6°39.3°
C18C19C20H6180.0°180.0°
C18C19C20C21179.9°5.7°
C1C2C23C2481.3°51.1°
C1C2C23N2120.9°113.2°
C1C2C23H7119.2°124.0°
C1C2N2H7119.4°125.5°
C1C2N2C911.8°17.0°
C1C2N2C3166.2°163.3°
C1C2C23H1439.9°170.4°
C1C2C23H15157.5°68.3°
C24C23C2H14121.2°119.3°
C24C23C2H15121.2°119.4°
C24C23C2N2157.8°164.3°
C24C23C2H738.0°72.9°
C24C23H14H15116.1°121.3°
C23C24C25H1661.8°2.8°
C23C24C25H1758.2°117.3°
C23C24C25H18178.2°122.8°
C23C24C26H1956.8°60.0°
C23C24C26H2063.2°180.0°
C23C24C26H21176.8°60.0°
C26C24C23C273.7°178.8°
C26C24C23H14165.1°59.4°
C26C24C23H1547.6°61.8°
C26C24C25H1663.1°115.5°
C26C24C25H17176.8°124.4°
C26C24C25H1856.9°4.5°
C24C26H19H20120.0°120.0°
C24C26H19H21120.0°120.0°
C24C26H20H21120.0°119.9°
C23C2N2H7119.5°123.4°
C23C2N2C9109.3°128.1°
C23C2N2C372.7°52.2°
C2C23H14H15116.1°121.3°
C20C19C18H529.5°22.2°
C19C20C21H80.3°94.3°
C19C20C21H9119.7°145.8°
C19C20C21H10120.3°25.7°
C19C20C22H11180.0°0.0°
C19C20C22H1260.0°120.0°
C19C20C22H1360.0°120.0°
C21C20C19H60.1°174.3°
C20C21H8H9120.0°120.0°
C20C21H8H10120.0°120.0°
C20C21H9H10120.0°120.1°
C21C20C22H110.3°180.0°
C21C20C22H12119.7°60.0°
C21C20C22H13120.3°60.1°
O4C8C9N3179.9°180.0°
O4C8C9N2146.7°177.3°
O4C8C9O594.7°57.2°
O4C8N3C70.2°17.8°
O4C8N3C4179.7°163.2°
C2N2C9C8144.6°175.0°
C2N2C9C3177.9°179.7°
C2N2C9O5101.8°64.6°
C2N2C3O37.3°0.3°
C2N2C3C4173.3°179.7°
N2C2C23H1481.0°76.4°
N2C2C23H1536.6°44.9°
C8C9N2O5113.6°120.4°
C8C9N2C337.5°5.2°
C9C8N3C7179.7°162.2°
C9C8N3C40.4°16.8°
C8C9C10H150.6°61.8°
C8C9O5H3263.2°57.5°
N2C9C8N333.4°2.7°
C9N2C3O3170.8°179.9°
C9N2C3C48.6°0.0°
N2C9C10H171.4°62.0°
C9N2C2H7131.2°108.6°
N2C9O5H3255.1°179.4°
O5C9C8N385.2°122.8°
O5C9N2C376.1°115.2°
O5C9C10H1163.8°179.7°
C8N3C7C4179.9°179.2°
C8N3C4C329.8°20.3°
C8N3C7C6177.9°140.0°
C8N3C4C5155.0°139.7°
C8N3C4H2590.7°101.5°
C8N3C7H3063.0°21.2°
C8N3C7H3158.8°101.2°
N2C3C4N325.2°11.7°
N2C3O3C4179.4°180.0°
N2C3C4C5142.6°126.7°
C3N2C2H746.8°71.2°
N2C3C4H2595.6°110.5°
C7N3C4C3150.1°158.9°
N3C7C6H30119.1°118.7°
N3C7C6H31119.1°118.8°
C7N3C4C524.8°39.6°
N3C7C6C521.8°23.3°
C7N3C4H2589.4°79.2°
N3C7C6H2897.4°95.6°
N3C7C6H29141.0°142.2°
N3C7H30H31122.6°122.5°
N3C4C3O3155.4°168.3°
N3C4C3C5117.4°115.1°
N3C4C3H25120.8°122.2°
C4N3C7C62.0°39.3°
N3C4C5H25114.8°119.2°
N3C4C5C637.1°23.8°
N3C4C5H2681.9°95.1°
N3C4C5H27156.0°142.6°
C4N3C7H30117.1°158.0°
C4N3C7H31121.1°79.5°
O3C3C4C538.0°53.2°
O3C3C4H2583.8°69.5°
C3C4C5H25121.9°122.7°
C3C4C5C6160.3°141.9°
C3C4C5H2641.4°23.0°
C3C4C5H2780.8°99.3°
C7C6C5C436.9°0.4°
C7C6C5H28119.2°118.9°
C7C6C5H29119.2°119.0°
C7C6C5H2682.0°118.5°
C7C6C5H27155.8°119.1°
C7C6H28H29122.2°122.3°
C6C7H30H31122.6°122.5°
C4C5C6H26118.9°118.9°
C4C5C6H27118.9°118.8°
C4C5H26H27123.2°122.3°
C4C5C6H2882.4°119.3°
C4C5C6H29156.1°118.6°
C6C5C4H2577.8°95.3°
C6C5H26H27123.2°122.3°
C5C6H28H29122.3°122.1°
C5C6C7H30140.9°142.0°
C5C6C7H3197.3°95.5°
H1C10O6H3368.4°58.2°
H2C13C14H30.1°0.1°
H5C18C19H6150.5°157.8°
H7C2C23H14159.2°46.5°
H7C2C23H1583.2°167.7°
H8C21H9H10120.0°120.0°
H11C22H12H13120.0°120.0°
H16C25H17H18120.0°119.9°
H19C26H20H21120.0°120.0°
H22C27H23H24120.0°120.0°
H25C4C5H26163.3°145.8°
H25C4C5H2741.1°23.5°
H26C5C6H28158.8°0.4°
H26C5C6H2937.2°122.5°
H27C5C6H2836.6°121.9°
H27C5C6H2985.0°0.2°
H28C6C7H3021.7°23.1°
H28C6C7H31143.5°145.6°
H29C6C7H3099.9°99.1°
H29C6C7H3121.9°23.4°

222415

PDB entries from 2024-07-10

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