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TMY

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2doub1.38Å1.41ÅAromatic
C1C6sing1.40Å1.48ÅAromatic
C1C13sing1.51Å1.47Å
C2C3sing1.39Å1.43ÅAromatic
C2O28sing1.36Å1.37Å
C3C4doub1.39Å1.39ÅAromatic
C3O29sing1.36Å1.37Å
C4C5sing1.38Å1.38ÅAromatic
C4O30sing1.36Å1.35Å
C5C6doub1.40Å1.38ÅAromatic
C6C19sing1.47Å1.51Å
C13C14sing1.51Å1.35Å
C14O15doub1.21Å1.34Å
C14O16sing1.34Å1.46Å
O16C17sing1.45Å1.43Å
C17C18sing1.53Å1.52Å
C19C20sing1.51Å1.51Å
C19O27doub1.21Å1.21Å
C20C21sing1.53Å1.53Å
C21C22sing1.53Å1.53Å
C22C23sing1.53Å1.54Å
C23C24sing1.53Å1.54Å
C24C25sing1.53Å1.53Å
C25C26sing1.53Å1.51Å
O28C31sing1.43Å1.43Å
O29C32sing1.43Å1.40Å
O30C33sing1.43Å1.43Å
C5H5sing1.08Å1.08Å
C13H13sing1.09Å1.10Å
C17H17sing1.09Å1.10Å
C17H17Asing1.09Å1.10Å
C18H18sing1.09Å1.10Å
C18H18Asing1.09Å1.10Å
C18H18Bsing1.09Å1.10Å
C20H20sing1.09Å1.10Å
C20H20Asing1.09Å1.10Å
C21H21sing1.09Å1.10Å
C21H21Asing1.09Å1.10Å
C22H22sing1.09Å1.10Å
C22H22Asing1.09Å1.10Å
C23H23sing1.09Å1.10Å
C23H23Asing1.09Å1.10Å
C24H24sing1.09Å1.10Å
C24H24Asing1.09Å1.10Å
C25H25sing1.09Å1.10Å
C25H25Asing1.09Å1.10Å
C26H26sing1.09Å1.10Å
C26H26Asing1.09Å1.10Å
C26H26Bsing1.09Å1.10Å
C31H31sing1.09Å1.10Å
C31H31Asing1.09Å1.10Å
C31H31Bsing1.09Å1.10Å
C32H32sing1.09Å1.10Å
C32H32Asing1.09Å1.10Å
C32H32Bsing1.09Å1.10Å
C33H33sing1.09Å1.10Å
C33H33Asing1.09Å1.10Å
C33H33Bsing1.09Å1.10Å
C13H13Asing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1C6118.9°119.9°
C2C1C13126.4°120.0°
C1C2C3118.9°120.1°
C1C2O28121.6°119.9°
C6C1C13114.6°120.1°
C1C6C5118.9°119.8°
C1C6C19124.3°120.0°
C1C13C14119.7°109.5°
C1C13H13106.9°109.4°
C1C13H13A106.9°109.5°
C3C2O28119.5°120.0°
C2C3C4120.7°120.2°
C2C3O29122.2°119.9°
C2O28C31117.9°117.0°
C4C3O29117.0°119.9°
C3C4C5121.2°120.1°
C3C4O30121.6°119.9°
C3O29C32114.4°117.0°
C5C4O30117.2°120.0°
C4C5C6121.3°119.9°
C4C5H5119.3°120.0°
C4O30C33119.8°117.0°
C5C6C19116.8°120.1°
C6C5H5119.3°120.0°
C6C19C20118.5°119.9°
C6C19O27120.1°120.0°
C13C14O15118.9°120.0°
C13C14O16121.7°120.0°
C14C13H13106.9°109.5°
C14C13H13A106.9°109.5°
O15C14O16119.4°120.0°
C14O16C17120.0°117.0°
O16C17C18114.8°109.5°
O16C17H17108.1°109.5°
O16C17H17A108.1°109.5°
C18C17H17108.1°109.4°
C18C17H17A108.1°109.4°
C17C18H18109.5°109.5°
C17C18H18A109.5°109.4°
C17C18H18B109.5°109.5°
C20C19O27121.4°120.0°
C19C20C21118.1°109.4°
C19C20H20107.3°109.5°
C19C20H20A107.3°109.5°
C20C21C22108.2°109.5°
C21C20H20107.3°109.4°
C21C20H20A107.3°109.5°
C20C21H21109.8°109.4°
C20C21H21A109.8°109.5°
C21C22C23113.1°109.5°
C22C21H21109.8°109.4°
C22C21H21A109.8°109.5°
C21C22H22108.6°109.5°
C21C22H22A108.6°109.5°
C22C23C24113.1°109.5°
C23C22H22108.5°109.5°
C23C22H22A108.5°109.5°
C22C23H23108.6°109.5°
C22C23H23A108.6°109.5°
C23C24C25112.4°109.5°
C24C23H23108.6°109.4°
C24C23H23A108.6°109.5°
C23C24H24108.7°109.5°
C23C24H24A108.7°109.5°
C24C25C26110.5°109.5°
C25C24H24108.7°109.5°
C25C24H24A108.7°109.5°
C24C25H25109.2°109.5°
C24C25H25A109.2°109.5°
C26C25H25109.2°109.5°
C26C25H25A109.2°109.5°
C25C26H26109.5°109.4°
C25C26H26A109.5°109.5°
C25C26H26B109.5°109.5°
O28C31H31109.5°109.5°
O28C31H31A109.4°109.5°
O28C31H31B109.5°109.5°
O29C32H32109.5°109.5°
O29C32H32A109.5°109.5°
O29C32H32B109.5°109.5°
O30C33H33109.5°109.5°
O30C33H33A109.5°109.4°
O30C33H33B109.5°109.5°
H13C13H13A109.5°109.4°
H17C17H17A109.5°109.5°
H18C18H18A109.5°109.4°
H18C18H18B109.5°109.5°
H18AC18H18B109.4°109.5°
H20C20H20A109.5°109.5°
H21C21H21A109.5°109.5°
H22C22H22A109.5°109.4°
H23C23H23A109.4°109.5°
H24C24H24A109.5°109.4°
H25C25H25A109.5°109.4°
H26C26H26A109.4°109.5°
H26C26H26B109.5°109.5°
H26AC26H26B109.5°109.5°
H31C31H31A109.5°109.4°
H31C31H31B109.5°109.5°
H31AC31H31B109.5°109.5°
H32C32H32A109.4°109.4°
H32C32H32B109.5°109.5°
H32AC32H32B109.5°109.4°
H33C33H33A109.5°109.5°
H33C33H33B109.4°109.5°
H33AC33H33B109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1C6C13179.9°179.7°
C1C2C3O28179.9°179.9°
C1C2C3C40.3°0.0°
C1C2C3O29178.3°179.9°
C2C1C6C50.5°0.1°
C2C1C6C19179.2°180.0°
C2C1C13C14113.5°94.8°
C1C2O28C3153.4°94.2°
C2C1C13H138.0°145.2°
C2C1C13H13A125.1°25.2°
C6C1C2C30.6°0.1°
C6C1C2O28179.4°180.0°
C1C6C5C40.1°0.1°
C1C6C5C19178.8°179.9°
C6C1C13C1466.6°85.5°
C1C6C19C20110.7°174.0°
C1C6C19O2771.6°5.9°
C1C6C5H5179.9°179.9°
C6C1C13H13171.9°34.5°
C6C1C13H13A54.8°154.4°
C13C1C2C3179.5°179.7°
C13C1C2O280.5°0.3°
C13C1C6C5179.6°179.8°
C13C1C6C190.9°0.3°
C1C13C14H13121.4°120.0°
C1C13C14H13A121.4°120.0°
C1C13C14O153.4°0.0°
C1C13C14O16177.3°180.0°
C1C13H13H13A115.4°120.0°
C2C3C4O29178.0°180.0°
C2C3C4C50.1°0.0°
C2C3C4O30180.0°180.0°
C3C2O28C31126.7°85.8°
C2C3O29C32104.9°93.7°
O28C2C3C4179.6°180.0°
O28C2C3O291.7°0.0°
C2O28C31H31180.0°54.8°
C2O28C31H31A60.0°65.1°
C2O28C31H31B60.0°174.8°
C3C4C5O30179.9°180.0°
C3C4C5C60.2°0.0°
C4C3O29C3273.1°86.4°
C3C4O30C33146.5°180.0°
C3C4C5H5179.8°179.9°
O29C3C4C5178.0°180.0°
O29C3C4O302.0°0.0°
C3O29C32H32180.0°65.0°
C3O29C32H32A60.0°175.1°
C3O29C32H32B60.0°55.0°
C4C5C6H5180.0°179.9°
C4C5C6C19178.9°180.0°
C5C4O30C3333.4°0.0°
O30C4C5C6179.9°180.0°
O30C4C5H50.1°0.1°
C4O30C33H33180.0°60.0°
C4O30C33H33A60.0°60.0°
C4O30C33H33B60.0°180.0°
C5C6C19C2068.0°6.0°
C5C6C19O27109.6°174.0°
C6C19C20O27177.6°180.0°
C6C19C20C21156.3°180.0°
C19C6C5H51.1°0.1°
C6C19C20H2082.5°60.1°
C6C19C20H20A35.0°60.0°
C13C14O15O16179.4°179.9°
C13C14O16C1774.0°180.0°
C14C13H13H13A115.4°120.0°
O15C14O16C17106.6°0.1°
O15C14C13H13118.1°120.0°
O15C14C13H13A124.8°120.0°
C14O16C17C1850.6°180.0°
O16C14C13H1361.3°60.0°
C14O16C17H17171.4°60.0°
C14O16C17H17A70.2°60.1°
O16C14C13H13A55.8°60.0°
O16C17C18H17120.8°120.0°
O16C17C18H17A120.8°120.0°
O16C17H17H17A117.6°120.1°
O16C17C18H18180.0°59.9°
O16C17C18H18A60.0°60.0°
O16C17C18H18B60.0°180.0°
C18C17H17H17A117.5°119.9°
C17C18H18H18A120.0°119.9°
C17C18H18H18B120.0°120.0°
C17C18H18AH18B120.0°120.0°
C19C20C21H20121.2°119.9°
C19C20C21H20A121.2°120.0°
C19C20C21C22148.0°180.0°
C19C20H20H20A116.1°120.0°
C19C20C21H2128.2°60.1°
C19C20C21H21A92.2°60.0°
O27C19C20C2126.1°0.0°
O27C19C20H2095.1°120.0°
O27C19C20H20A147.3°120.0°
C20C21C22H21119.8°119.9°
C20C21C22H21A119.8°120.1°
C20C21C22C2357.0°180.0°
C21C20H20H20A116.1°120.0°
C20C21H21H21A120.6°120.0°
C20C21C22H2263.5°60.0°
C20C21C22H22A177.5°59.9°
C21C22C23H22120.5°120.0°
C21C22C23H22A120.5°120.0°
C21C22C23C24119.6°180.0°
C22C21C20H2090.8°60.1°
C22C21C20H20A26.8°60.0°
C22C21H21H21A120.6°120.0°
C21C22H22H22A118.4°120.0°
C21C22C23H23119.8°60.0°
C21C22C23H23A0.9°60.0°
C22C23C24H23120.6°120.0°
C22C23C24H23A120.6°120.0°
C22C23C24C25174.9°180.0°
C23C22C21H21176.8°60.0°
C23C22C21H21A62.8°60.0°
C23C22H22H22A118.3°120.0°
C22C23H23H23A118.3°120.0°
C22C23C24H2454.4°60.0°
C22C23C24H24A64.7°60.0°
C23C24C25H24120.5°120.0°
C23C24C25H24A120.4°120.0°
C23C24C25C26153.2°180.0°
C24C23C22H220.9°60.0°
C24C23C22H22A119.9°60.0°
C24C23H23H23A118.3°120.0°
C23C24H24H24A118.6°120.0°
C23C24C25H2586.6°60.0°
C23C24C25H25A33.1°60.0°
C24C25C26H25120.2°120.0°
C24C25C26H25A120.1°120.0°
C25C24C23H2364.6°60.0°
C25C24C23H23A54.3°60.0°
C25C24H24H24A118.7°120.0°
C24C25H25H25A119.5°120.0°
C24C25C26H26180.0°60.0°
C24C25C26H26A60.0°60.0°
C24C25C26H26B60.0°180.0°
C26C25C24H2432.8°60.0°
C26C25C24H24A86.4°60.0°
C26C25H25H25A119.5°120.0°
C25C26H26H26A120.0°120.0°
C25C26H26H26B120.0°120.0°
C25C26H26AH26B120.0°120.0°
O28C31H31H31A120.0°120.0°
O28C31H31H31B120.0°120.0°
O28C31H31AH31B120.0°120.0°
O29C32H32H32A120.0°120.0°
O29C32H32H32B120.0°120.1°
O29C32H32AH32B120.0°120.1°
O30C33H33H33A120.0°120.0°
O30C33H33H33B120.0°120.0°
O30C33H33AH33B120.0°120.0°
H17C17C18H1859.2°180.0°
H17C17C18H18A179.2°60.0°
H17C17C18H18B60.8°60.0°
H17AC17C18H1859.2°60.0°
H17AC17C18H18A60.8°180.0°
H17AC17C18H18B179.3°60.0°
H18C18H18AH18B120.0°120.1°
H20C20C21H21149.4°180.0°
H20C20C21H21A29.0°60.0°
H20AC20C21H2193.0°60.0°
H20AC20C21H21A146.6°180.0°
H21C21C22H2256.3°179.9°
H21C21C22H22A62.7°60.0°
H21AC21C22H22176.7°60.1°
H21AC21C22H22A57.7°180.0°
H22C22C23H23119.6°179.9°
H22C22C23H23A121.5°60.0°
H22AC22C23H230.7°60.0°
H22AC22C23H23A119.6°180.0°
H23C23C24H24175.0°180.0°
H23C23C24H24A55.9°60.0°
H23AC23C24H2466.2°60.0°
H23AC23C24H24A174.7°180.0°
H24C24C25H25152.9°180.0°
H24C24C25H25A87.4°60.0°
H24AC24C25H2533.8°60.0°
H24AC24C25H25A153.5°180.0°
H25C25C26H2659.9°180.0°
H25C25C26H26A179.9°60.0°
H25C25C26H26B60.1°60.0°
H25AC25C26H2659.8°60.0°
H25AC25C26H26A60.1°180.0°
H25AC25C26H26B179.8°60.0°
H26C26H26AH26B120.0°120.0°
H31C31H31AH31B120.0°120.0°
H32C32H32AH32B120.0°120.0°
H33C33H33AH33B120.0°120.0°

249697

PDB entries from 2026-02-25

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