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3E8

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C30C32sing1.53Å1.54Å
C30C29sing1.53Å1.52Å
C32N34sing1.47Å1.48Å
O26C25sing1.36Å1.37Å
O26C28sing1.43Å1.42Å
C24C25doub1.39Å1.37ÅAromatic
C24N22sing1.32Å1.37ÅAromatic
C25C23sing1.39Å1.39ÅAromatic
N22C20doub1.33Å1.39ÅAromatic
C28C29sing1.53Å1.53Å
C23N21doub1.32Å1.37ÅAromatic
C29C31sing1.53Å1.54Å
C20N21sing1.33Å1.37ÅAromatic
C20C18sing1.48Å1.46Å
C16C18doub1.39Å1.39ÅAromatic
C16C14sing1.38Å1.39ÅAromatic
C18C19sing1.39Å1.39ÅAromatic
N34C35sing1.47Å1.48Å
N34C33sing1.47Å1.48Å
C13C14sing1.51Å1.52Å
C13N11sing1.46Å1.47Å
C5C3doub1.38Å1.39ÅAromatic
C5C6sing1.38Å1.39ÅAromatic
C14C15doub1.38Å1.38ÅAromatic
C3C1sing1.40Å1.40ÅAromatic
C19C17doub1.38Å1.37ÅAromatic
C6C4doub1.40Å1.39ÅAromatic
C31C33sing1.53Å1.55Å
C15C17sing1.38Å1.39ÅAromatic
N9N11sing1.28Å1.39Å
N9C7doub1.31Å1.30Å
N11C12sing1.35Å1.37Å
C1C7sing1.48Å1.47Å
C1C2doub1.39Å1.39ÅAromatic
C4C2sing1.39Å1.40ÅAromatic
C4C36sing1.43Å1.42Å
C7C8sing1.41Å1.48Å
C36N37trip1.14Å1.16Å
C12O27doub1.22Å1.22Å
C12C10sing1.41Å1.46Å
C8C10doub1.36Å1.34Å
C2H1sing1.08Å1.08Å
C3H2sing1.08Å1.08Å
C5H3sing1.08Å1.08Å
C6H4sing1.08Å1.08Å
C8H5sing1.08Å1.08Å
C15H6sing1.08Å1.08Å
C16H7sing1.08Å1.08Å
C17H8sing1.08Å1.08Å
C19H9sing1.08Å1.08Å
C23H10sing1.08Å1.08Å
C24H11sing1.08Å1.08Å
C30H12sing1.09Å1.10Å
C30H13sing1.09Å1.10Å
C31H14sing1.09Å1.10Å
C31H15sing1.09Å1.10Å
C32H16sing1.09Å1.10Å
C32H17sing1.09Å1.10Å
C33H18sing1.09Å1.10Å
C33H19sing1.09Å1.10Å
C35H20sing1.09Å1.10Å
C35H21sing1.09Å1.10Å
C35H22sing1.09Å1.10Å
C10H23sing1.08Å1.08Å
C13H24sing1.09Å1.10Å
C13H25sing1.09Å1.10Å
C28H26sing1.09Å1.10Å
C28H27sing1.09Å1.10Å
C29H28sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C32C30C29106.4°109.3°
C30C32N34111.4°109.5°
C32C30H12110.2°109.5°
C32C30H13110.2°109.5°
C30C32H16109.0°109.5°
C30C32H17109.0°109.5°
C30C29C28110.8°109.5°
C30C29C31108.7°109.1°
C29C30H12110.2°109.5°
C29C30H13110.2°109.5°
C30C29H28108.6°109.5°
C32N34C35109.8°111.0°
C32N34C33114.5°111.2°
N34C32H16109.0°109.4°
N34C32H17109.0°109.4°
C25O26C28120.9°117.0°
O26C25C24116.9°120.8°
O26C25C23122.6°120.8°
O26C28C29113.5°109.5°
O26C28H26108.5°109.4°
O26C28H27108.5°109.4°
C25C24N22120.6°119.1°
C24C25C23120.5°118.4°
C25C24H11119.7°120.4°
C24N22C20118.3°120.8°
N22C24H11119.7°120.5°
C25C23N21119.4°119.1°
C25C23H10120.3°120.4°
N22C20N21121.9°121.7°
N22C20C18118.8°119.1°
C28C29C31111.9°109.5°
C29C28H26108.4°109.5°
C29C28H27108.5°109.5°
C28C29H28108.4°109.5°
C23N21C20119.2°120.8°
N21C23H10120.3°120.4°
C29C31C33108.8°109.3°
C29C31H14109.6°109.5°
C29C31H15109.6°109.5°
C31C29H28108.3°109.6°
N21C20C18118.9°119.2°
C20C18C16119.0°120.1°
C20C18C19120.8°120.2°
C18C16C14121.0°119.9°
C16C18C19119.7°119.7°
C18C16H7119.5°120.1°
C16C14C13121.1°120.0°
C16C14C15118.3°120.1°
C14C16H7119.5°120.0°
C18C19C17119.6°119.9°
C18C19H9120.2°120.0°
C35N34C33111.3°111.0°
N34C35H20109.5°109.4°
N34C35H21109.5°109.5°
N34C35H22109.5°109.5°
N34C33C31109.1°109.6°
N34C33H18109.6°109.4°
N34C33H19109.6°109.5°
C14C13N11109.2°109.5°
C13C14C15120.5°119.9°
C14C13H24109.5°109.5°
C14C13H25109.5°109.5°
C13N11N9112.2°119.1°
C13N11C12123.6°119.1°
N11C13H24109.5°109.4°
N11C13H25109.5°109.5°
C3C5C6121.0°120.2°
C5C3C1119.7°120.2°
C5C3H2120.1°119.9°
C3C5H3119.5°119.9°
C5C6C4118.8°120.1°
C6C5H3119.5°119.9°
C5C6H4120.6°119.9°
C14C15C17120.9°120.3°
C14C15H6119.6°119.9°
C3C1C7119.0°120.0°
C3C1C2119.7°119.9°
C1C3H2120.2°119.9°
C19C17C15120.5°120.1°
C19C17H8119.7°120.0°
C17C19H9120.2°120.1°
C6C4C2120.9°119.8°
C6C4C36120.2°120.1°
C4C6H4120.6°119.9°
C33C31H14109.6°109.5°
C33C31H15109.6°109.5°
C31C33H18109.6°109.5°
C31C33H19109.6°109.5°
C17C15H6119.6°119.8°
C15C17H8119.8°119.9°
N11N9C7119.9°122.3°
N9N11C12124.0°121.8°
N9C7C1117.2°119.8°
N9C7C8119.7°120.3°
N11C12O27120.2°120.2°
N11C12C10116.4°119.5°
C7C1C2121.2°120.1°
C1C7C8123.1°119.9°
C1C2C4119.9°119.8°
C1C2H1120.0°120.1°
C2C4C36118.8°120.1°
C4C2H1120.1°120.1°
C4C36N37175.8°180.0°
C7C8C10120.5°118.2°
C7C8H5119.8°120.9°
O27C12C10123.4°120.2°
C12C10C8119.5°117.9°
C12C10H23120.3°121.0°
C10C8H5119.7°120.9°
C8C10H23120.2°121.1°
H12C30H13109.5°109.6°
H14C31H15109.5°109.5°
H16C32H17109.5°109.5°
H18C33H19109.5°109.4°
H20C35H21109.5°109.4°
H20C35H22109.5°109.4°
H21C35H22109.5°109.5°
H24C13H25109.5°109.5°
H26C28H27109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C32C30C29H12119.5°119.9°
C32C30C29H13119.5°120.0°
C30C32N34H16120.3°120.0°
C30C32N34H17120.3°120.0°
C32C30C29C28173.0°177.6°
C32C30C29C3163.6°57.7°
C30C32N34C35178.7°174.1°
C30C32N34C3355.4°61.7°
C32C30H12H13121.4°120.1°
C30C32H16H17119.1°120.0°
C32C30C29H2854.0°62.3°
C29C30C32N3458.4°59.2°
C30C29C28O2642.5°175.0°
C30C29C28C31121.5°119.6°
C30C29C28H28119.0°120.2°
C30C29C31H28117.8°119.9°
C30C29C31C3364.6°57.7°
C29C30H12H13121.4°120.1°
C30C29C31H14175.5°62.3°
C30C29C31H1555.3°177.6°
C29C30C32H16178.7°179.2°
C29C30C32H1761.9°60.8°
C30C29C28H2678.1°65.0°
C30C29C28H27163.0°55.0°
C32N34C35C33127.7°124.3°
C32N34C33C3153.6°61.7°
N34C32C30H12177.9°179.1°
N34C32C30H1361.2°60.8°
N34C32H16H17119.1°119.9°
C32N34C33H18173.6°58.3°
C32N34C33H1966.3°178.2°
C32N34C35H20180.0°60.1°
C32N34C35H2160.0°180.0°
C32N34C35H2260.0°59.9°
O26C25C24C23178.8°180.0°
O26C25C24N22179.0°180.0°
C25O26C28C29147.2°180.0°
O26C25C23N21179.8°180.0°
O26C25C23H100.2°0.0°
O26C25C24H111.0°0.0°
C25O26C28H2692.2°59.9°
C25O26C28H2726.6°60.0°
C28O26C25C24161.0°180.0°
C28O26C25C2320.2°0.0°
O26C28C29H26120.6°120.0°
O26C28C29H27120.6°120.0°
O26C28C29C3179.1°65.4°
O26C28H26H27118.2°119.9°
O26C28C29H28161.5°54.9°
C25C24N22H11180.0°180.0°
C25C24N22C200.6°0.0°
C24C25C23N211.5°0.0°
C24C25C23H10178.5°180.0°
N22C24C25C230.2°0.0°
C24N22C20N210.0°0.1°
C24N22C20C18173.0°180.0°
C25C23N21H10180.0°180.0°
C25C23N21C202.0°0.0°
C23C25C24H11179.8°180.0°
N22C20N21C231.3°0.0°
N22C20N21C18173.0°179.9°
N22C20C18C163.0°180.0°
N22C20C18C19169.5°0.8°
C20N22C24H11179.5°179.9°
C28C29C31H28119.5°120.2°
C28C29C31C33172.7°177.5°
C28C29C30H1253.5°62.6°
C28C29C30H1367.5°57.6°
C28C29C31H1452.8°57.6°
C28C29C31H1567.4°62.5°
C29C28H26H27118.2°120.0°
C23N21C20C18174.3°180.0°
C29C31C33N3457.2°59.2°
C29C31C33H14119.9°119.9°
C29C31C33H15119.9°120.0°
C31C29C30H12176.9°177.6°
C31C29C30H1355.9°62.3°
C29C31H14H15120.3°120.1°
C29C31C33H18177.1°60.8°
C29C31C33H1962.7°179.2°
C31C29C28H26160.4°54.6°
C31C29C28H2741.5°174.6°
N21C20C18C16176.2°0.0°
N21C20C18C193.7°179.2°
C20N21C23H10178.0°180.0°
C20C18C16C19172.6°179.2°
C20C18C16C14174.5°180.0°
C20C18C19C17175.0°179.7°
C20C18C16H75.5°0.9°
C20C18C19H95.0°0.3°
C18C16C14H7180.0°179.1°
C18C16C14C13179.3°180.0°
C18C16C14C150.8°0.5°
C16C18C19C172.5°0.5°
C16C18C19H9177.5°179.5°
C14C16C18C191.9°0.8°
C16C14C13C15178.4°179.4°
C16C14C13N1182.7°90.0°
C16C14C15C170.4°0.0°
C16C14C15H6179.6°179.7°
C16C14C13H24157.4°30.0°
C16C14C13H2537.3°150.0°
C18C19C17H9180.0°180.0°
C18C19C17C152.1°0.0°
C19C18C16H7178.1°179.9°
C18C19C17H8177.9°180.0°
C35N34C33C31178.8°174.1°
C35N34C32H1658.4°54.1°
C35N34C32H1761.0°65.9°
C35N34C33H1861.3°65.9°
C35N34C33H1958.8°54.0°
N34C35H20H21120.0°120.0°
N34C35H20H22120.0°120.0°
N34C35H21H22120.0°120.1°
N34C33C31H18119.9°120.0°
N34C33C31H19120.0°120.1°
N34C33C31H14177.1°60.8°
N34C33C31H1562.7°179.1°
C33N34C32H16175.7°178.3°
C33N34C32H1764.9°58.3°
N34C33H18H19120.2°119.9°
C33N34C35H2052.3°64.2°
C33N34C35H21172.3°55.7°
C33N34C35H2267.7°175.8°
C14C13N11H24120.0°120.0°
C14C13N11H25119.9°120.1°
C13C14C15C17178.8°179.4°
C14C13N11N978.6°90.0°
C14C13N11C1296.7°90.0°
C13C14C15H61.1°0.3°
C13C14C16H70.7°0.9°
C14C13H24H25120.1°120.0°
N11C13C14C1595.7°89.5°
C13N11N9C12175.2°180.0°
C13N11N9C7176.9°180.0°
C13N11C12O274.7°0.1°
C13N11C12C10177.4°179.8°
N11C13H24H25120.1°120.0°
C3C5C6H3180.0°180.0°
C5C3C1H2180.0°179.9°
C3C5C6C41.2°0.3°
C5C3C1C7178.9°179.9°
C5C3C1C21.4°0.2°
C3C5C6H4178.8°180.0°
C6C5C3C11.6°0.0°
C5C6C4H4180.0°179.7°
C5C6C4C20.5°0.3°
C5C6C4C36178.9°179.8°
C6C5C3H2178.4°180.0°
C14C15C17C191.1°0.3°
C14C15C17H6180.0°179.7°
C15C14C16H7179.2°179.7°
C14C15C17H8179.0°179.7°
C15C14C13H2424.3°150.6°
C15C14C13H25144.3°30.6°
C3C1C7N921.7°179.5°
C3C1C7C2177.5°179.7°
C3C1C2C40.7°0.3°
C3C1C7C8159.9°0.3°
C3C1C2H1179.3°179.7°
C1C3C5H3178.4°179.9°
C19C17C15H8180.0°180.0°
C19C17C15H6178.9°180.0°
C6C4C2C10.3°0.0°
C6C4C2C36178.4°180.0°
C6C4C36N37113.0°135.0°
C6C4C2H1179.7°180.0°
C4C6C5H3178.8°179.7°
C33C31H14H15120.3°120.1°
C31C33H18H19120.2°120.0°
C33C31C29H2853.2°62.3°
C15C17C19H9177.9°180.0°
N11N9C7C1178.8°180.0°
N11N9C7C80.4°0.2°
N9N11C12O27179.4°180.0°
N9N11C12C102.7°0.2°
N9N11C13H24161.5°30.0°
N9N11C13H2541.4°150.0°
C7N9N11C121.7°0.0°
N9C7C1C8178.4°179.8°
N9C7C1C2155.8°0.2°
N9C7C8C101.2°0.3°
N9C7C8H5178.8°179.8°
N11C12O27C10177.7°179.8°
N11C12C10C81.8°0.2°
N11C12C10H23178.2°179.7°
C12N11C13H2423.3°150.0°
C12N11C13H25143.4°30.0°
C7C1C2C4178.2°180.0°
C1C7C8C10179.5°180.0°
C7C1C2H11.8°0.0°
C7C1C3H21.1°0.0°
C1C7C8H50.5°0.1°
C1C2C4H1180.0°180.0°
C1C2C4C36178.7°180.0°
C2C1C7C822.6°180.0°
C2C1C3H2178.7°179.7°
C2C4C36N3765.4°45.0°
C2C4C6H4179.5°180.0°
C36C4C2H11.3°0.0°
C36C4C6H41.1°0.0°
C7C8C10C120.0°0.1°
C7C8C10H5180.0°179.9°
C7C8C10H23180.0°180.0°
O27C12C10C8179.6°180.0°
O27C12C10H230.4°0.1°
C12C10C8H23180.0°179.9°
C12C10C8H5180.0°180.0°
H2C3C5H31.6°0.0°
H3C5C6H41.2°0.0°
H5C8C10H230.0°0.1°
H6C15C17H81.1°0.1°
H8C17C19H92.1°0.0°
H12C30C32H1661.8°60.9°
H12C30C32H1757.6°59.1°
H12C30C29H2865.4°57.6°
H13C30C32H1659.1°59.2°
H13C30C32H17178.6°179.2°
H13C30C29H28173.6°177.7°
H14C31C33H1863.0°179.3°
H14C31C33H1957.1°59.3°
H14C31C29H2866.7°177.8°
H15C31C33H1857.2°59.1°
H15C31C33H19177.3°60.8°
H15C31C29H28173.1°57.7°
H20C35H21H22120.0°120.0°
H26C28C29H2840.9°174.9°
H27C28C29H2877.9°65.1°

222415

PDB entries from 2024-07-10

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