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CMJ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C2C3sing1.53Å1.52Å
C2C1sing1.53Å1.52Å
C4C5sing1.53Å1.52Å
C4C3sing1.53Å1.52Å
C5C6sing1.53Å1.52Å
C6C7sing1.53Å1.50Å
C43C42sing1.53Å1.51Å
C42C41sing1.53Å1.52Å
C41C40sing1.53Å1.52Å
C40C39sing1.53Å1.51Å
C39C38sing1.53Å1.51Å
C38C37sing1.53Å1.52Å
C37C36sing1.53Å1.52Å
C36C35sing1.53Å1.51Å
C35C34sing1.53Å1.51Å
C34C33sing1.53Å1.52Å
C33C32sing1.53Å1.52Å
C32C31sing1.53Å1.52Å
C31C30sing1.53Å1.52Å
C30C29sing1.53Å1.52Å
C29C28sing1.53Å1.52Å
C28C27sing1.53Å1.52Å
C27C26sing1.53Å1.52Å
C26C25sing1.53Å1.52Å
C25C24sing1.53Å1.52Å
C24C23sing1.53Å1.52Å
C23C22sing1.53Å1.52Å
C22C20sing1.53Å1.51Å
C20C21sing1.53Å1.53Å
C20C19sing1.53Å1.52Å
C19C18sing1.53Å1.52Å
C18C17sing1.53Å1.52Å
C17C16sing1.53Å1.52Å
C16C15sing1.53Å1.53Å
C15C14sing1.53Å1.53Å
C14C13sing1.53Å1.54Å
C13C12sing1.53Å1.53Å
C12C11sing1.53Å1.51Å
C11C10sing1.53Å1.50Å
C10C9sing1.53Å1.51Å
C9C8sing1.53Å1.52Å
C8C7sing1.53Å1.51Å
C2H2sing1.09Å1.10Å
C2H2Asing1.09Å1.10Å
C4H4sing1.09Å1.10Å
C4H4Asing1.09Å1.10Å
C5H5sing1.09Å1.10Å
C5H5Asing1.09Å1.10Å
C6H6sing1.09Å1.10Å
C6H6Asing1.09Å1.10Å
C43H43sing1.09Å1.10Å
C43H43Asing1.09Å1.10Å
C43H43Bsing1.09Å1.10Å
C42H42sing1.09Å1.10Å
C42H42Asing1.09Å1.10Å
C41H41sing1.09Å1.10Å
C41H41Asing1.09Å1.10Å
C40H40sing1.09Å1.10Å
C40H40Asing1.09Å1.10Å
C39H39sing1.09Å1.10Å
C39H39Asing1.09Å1.10Å
C38H38sing1.09Å1.10Å
C38H38Asing1.09Å1.10Å
C37H37sing1.09Å1.10Å
C37H37Asing1.09Å1.10Å
C36H36sing1.09Å1.10Å
C36H36Asing1.09Å1.10Å
C35H35sing1.09Å1.10Å
C35H35Asing1.09Å1.10Å
C34H34sing1.09Å1.10Å
C34H34Asing1.09Å1.10Å
C33H33sing1.09Å1.10Å
C33H33Asing1.09Å1.10Å
C32H32sing1.09Å1.10Å
C32H32Asing1.09Å1.10Å
C31H31sing1.09Å1.10Å
C31H31Asing1.09Å1.10Å
C30H30sing1.09Å1.10Å
C30H30Asing1.09Å1.10Å
C29H29sing1.09Å1.10Å
C29H29Asing1.09Å1.10Å
C28H28sing1.09Å1.10Å
C28H28Asing1.09Å1.10Å
C27H27sing1.09Å1.10Å
C27H27Asing1.09Å1.10Å
C26H26sing1.09Å1.10Å
C26H26Asing1.09Å1.10Å
C25H25sing1.09Å1.10Å
C25H25Asing1.09Å1.10Å
C24H24sing1.09Å1.10Å
C24H24Asing1.09Å1.10Å
C23H23sing1.09Å1.10Å
C23H23Asing1.09Å1.10Å
C22H22sing1.09Å1.10Å
C22H22Asing1.09Å1.10Å
C20H20sing1.09Å1.10Å
C21H21sing1.09Å1.10Å
C21H21Asing1.09Å1.10Å
C21H21Bsing1.09Å1.10Å
C19H19sing1.09Å1.10Å
C19H19Asing1.09Å1.10Å
C18H18sing1.09Å1.10Å
C18H18Asing1.09Å1.10Å
C17H17sing1.09Å1.10Å
C17H17Asing1.09Å1.10Å
C16H16sing1.09Å1.10Å
C16H16Asing1.09Å1.10Å
C15H15sing1.09Å1.10Å
C15H15Asing1.09Å1.10Å
C14H14sing1.09Å1.10Å
C14H14Asing1.09Å1.10Å
C13H13sing1.09Å1.10Å
C13H13Asing1.09Å1.10Å
C12H12sing1.09Å1.10Å
C12H12Asing1.09Å1.10Å
C11H11sing1.09Å1.10Å
C11H11Asing1.09Å1.10Å
C10H10sing1.09Å1.10Å
C10H10Asing1.09Å1.10Å
C9H9sing1.09Å1.10Å
C9H9Asing1.09Å1.10Å
C8H8sing1.09Å1.10Å
C8H8Asing1.09Å1.10Å
C7H7sing1.09Å1.10Å
C7H7Asing1.09Å1.10Å
C3H3sing1.09Å1.10Å
C3H3Asing1.09Å1.10Å
C1H1sing1.09Å1.10Å
C1H1Asing1.09Å1.10Å
C1H1Bsing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C3C2C1111.0°109.5°
C2C3C4109.2°109.5°
C3C2H2108.9°109.5°
C3C2H2A108.6°109.5°
C2C3H3109.6°109.5°
C2C3H3A109.6°109.5°
C1C2H2109.0°109.5°
C1C2H2A108.6°109.5°
C2C1H1109.5°109.5°
C2C1H1A109.4°109.5°
C2C1H1B109.4°109.4°
C5C4C3111.2°109.5°
C4C5C6110.3°109.5°
C5C4H4108.9°109.5°
C5C4H4A108.5°109.5°
C4C5H5109.2°109.5°
C4C5H5A109.0°109.5°
C3C4H4108.9°109.4°
C3C4H4A108.5°109.5°
C4C3H3109.6°109.4°
C4C3H3A109.6°109.4°
C5C6C7107.7°109.5°
C6C5H5109.2°109.4°
C6C5H5A109.0°109.5°
C5C6H6110.1°109.5°
C5C6H6A110.5°109.5°
C6C7C8110.9°109.5°
C7C6H6110.1°109.5°
C7C6H6A110.5°109.5°
C6C7H7109.0°109.4°
C6C7H7A108.7°109.5°
C43C42C41109.5°109.4°
C42C43H43109.5°109.5°
C42C43H43A109.5°109.4°
C42C43H43B109.4°109.4°
C43C42H42109.4°109.5°
C43C42H42A109.5°109.4°
C42C41C40111.0°109.4°
C41C42H42109.5°109.5°
C41C42H42A109.5°109.5°
C42C41H41108.9°109.5°
C42C41H41A108.6°109.5°
C41C40C39108.0°109.4°
C40C41H41109.0°109.5°
C40C41H41A108.6°109.4°
C41C40H40110.0°109.5°
C41C40H40A110.3°109.4°
C40C39C38108.7°109.4°
C39C40H40109.9°109.5°
C39C40H40A110.3°109.5°
C40C39H39109.8°109.5°
C40C39H39A109.9°109.5°
C39C38C37111.3°109.4°
C38C39H39109.8°109.5°
C38C39H39A109.9°109.4°
C39C38H38108.9°109.5°
C39C38H38A108.5°109.4°
C38C37C36110.6°109.4°
C37C38H38108.9°109.5°
C37C38H38A108.4°109.5°
C38C37H37109.1°109.5°
C38C37H37A108.8°109.5°
C37C36C35109.0°109.4°
C36C37H37109.1°109.5°
C36C37H37A108.8°109.4°
C37C36H36109.6°109.5°
C37C36H36A109.7°109.4°
C36C35C34110.0°109.4°
C35C36H36109.6°109.5°
C35C36H36A109.7°109.5°
C36C35H35109.3°109.5°
C36C35H35A109.2°109.5°
C35C34C33108.0°109.4°
C34C35H35109.3°109.5°
C34C35H35A109.1°109.4°
C35C34H34110.0°109.5°
C35C34H34A110.3°109.4°
C34C33C32109.7°109.4°
C33C34H34110.0°109.5°
C33C34H34A110.3°109.5°
C34C33H33109.4°109.5°
C34C33H33A109.3°109.5°
C33C32C31111.5°109.5°
C32C33H33109.4°109.5°
C32C33H33A109.4°109.4°
C33C32H32108.8°109.5°
C33C32H32A108.3°109.5°
C32C31C30110.8°109.5°
C31C32H32108.8°109.5°
C31C32H32A108.4°109.5°
C32C31H31109.0°109.5°
C32C31H31A108.7°109.5°
C31C30C29109.1°109.5°
C30C31H31109.0°109.5°
C30C31H31A108.7°109.4°
C31C30H30109.6°109.5°
C31C30H30A109.7°109.4°
C30C29C28110.4°109.5°
C29C30H30109.6°109.5°
C29C30H30A109.6°109.5°
C30C29H29109.1°109.5°
C30C29H29A108.9°109.5°
C29C28C27111.3°109.5°
C28C29H29109.2°109.4°
C28C29H29A109.0°109.5°
C29C28H28108.9°109.4°
C29C28H28A108.5°109.5°
C28C27C26110.9°109.5°
C27C28H28108.9°109.5°
C27C28H28A108.4°109.5°
C28C27H27109.0°109.5°
C28C27H27A108.7°109.5°
C27C26C25111.4°109.4°
C26C27H27109.0°109.5°
C26C27H27A108.7°109.5°
C27C26H26108.8°109.5°
C27C26H26A108.4°109.4°
C26C25C24110.0°109.4°
C25C26H26108.8°109.5°
C25C26H26A108.4°109.5°
C26C25H25109.3°109.5°
C26C25H25A109.2°109.5°
C25C24C23112.8°109.4°
C24C25H25109.3°109.5°
C24C25H25A109.2°109.4°
C25C24H24108.4°109.5°
C25C24H24A107.6°109.4°
C24C23C22111.2°109.4°
C23C24H24108.4°109.5°
C23C24H24A107.6°109.5°
C24C23H23108.9°109.5°
C24C23H23A108.5°109.5°
C23C22C20112.4°109.4°
C22C23H23108.9°109.5°
C22C23H23A108.5°109.4°
C23C22H22108.5°109.5°
C23C22H22A107.8°109.4°
C22C20C21111.3°109.5°
C22C20C19107.7°109.4°
C20C22H22108.5°109.5°
C20C22H22A107.8°109.5°
C22C20H20110.6°109.5°
C21C20C19112.8°109.5°
C21C20H20105.3°109.5°
C20C21H21109.5°109.5°
C20C21H21A109.4°109.5°
C20C21H21B109.4°109.5°
C20C19C18113.6°109.5°
C19C20H20109.1°109.5°
C20C19H19108.1°109.5°
C20C19H19A107.2°109.5°
C19C18C17110.1°109.5°
C18C19H19108.1°109.5°
C18C19H19A107.2°109.4°
C19C18H18109.3°109.5°
C19C18H18A109.1°109.5°
C18C17C16112.0°109.5°
C17C18H18109.3°109.5°
C17C18H18A109.2°109.5°
C18C17H17108.6°109.5°
C18C17H17A108.1°109.4°
C17C16C15111.0°109.4°
C16C17H17108.6°109.5°
C16C17H17A108.1°109.5°
C17C16H16109.0°109.5°
C17C16H16A108.6°109.5°
C16C15C14114.0°109.5°
C15C16H16108.9°109.5°
C15C16H16A108.6°109.5°
C16C15H15108.0°109.5°
C16C15H15A106.9°109.5°
C15C14C13112.7°109.5°
C14C15H15108.0°109.5°
C14C15H15A107.0°109.4°
C15C14H14108.4°109.5°
C15C14H14A107.7°109.5°
C14C13C12111.9°109.5°
C13C14H14108.4°109.5°
C13C14H14A107.7°109.5°
C14C13H13108.6°109.5°
C14C13H13A108.1°109.4°
C13C12C11108.9°109.4°
C12C13H13108.7°109.5°
C12C13H13A108.1°109.5°
C13C12H12109.6°109.5°
C13C12H12A109.8°109.5°
C12C11C10111.4°109.5°
C11C12H12109.7°109.5°
C11C12H12A109.8°109.5°
C12C11H11108.8°109.5°
C12C11H11A108.4°109.5°
C11C10C9110.7°109.5°
C10C11H11108.8°109.5°
C10C11H11A108.4°109.4°
C11C10H10109.1°109.5°
C11C10H10A108.8°109.5°
C10C9C8111.1°109.5°
C9C10H10109.1°109.5°
C9C10H10A108.8°109.5°
C10C9H9108.9°109.5°
C10C9H9A108.6°109.4°
C9C8C7107.7°109.4°
C8C9H9108.9°109.5°
C8C9H9A108.6°109.5°
C9C8H8110.1°109.5°
C9C8H8A110.5°109.5°
C7C8H8110.0°109.4°
C7C8H8A110.5°109.5°
C8C7H7109.0°109.5°
C8C7H7A108.6°109.5°
H2C2H2A110.7°109.5°
H4C4H4A110.9°109.5°
H5C5H5A110.1°109.5°
H6C6H6A108.1°109.5°
H43C43H43A109.5°109.5°
H43C43H43B109.4°109.5°
H43AC43H43B109.5°109.5°
H42C42H42A109.5°109.5°
H41C41H41A110.7°109.5°
H40C40H40A108.3°109.5°
H39C39H39A108.8°109.5°
H38C38H38A110.9°109.5°
H37C37H37A110.3°109.5°
H36C36H36A109.1°109.5°
H35C35H35A109.9°109.5°
H34C34H34A108.3°109.5°
H33C33H33A109.6°109.5°
H32C32H32A111.1°109.5°
H31C31H31A110.5°109.5°
H30C30H30A109.2°109.5°
H29C29H29A110.2°109.4°
H28C28H28A110.9°109.4°
H27C27H27A110.6°109.4°
H26C26H26A111.0°109.5°
H25C25H25A109.9°109.5°
H24C24H24A112.1°109.5°
H23C23H23A110.8°109.5°
H22C22H22A111.8°109.5°
H21C21H21A109.5°109.4°
H21C21H21B109.5°109.5°
H21AC21H21B109.5°109.4°
H19C19H19A112.7°109.5°
H18C18H18A109.9°109.5°
H17C17H17A111.5°109.5°
H16C16H16A110.7°109.5°
H15C15H15A113.1°109.5°
H14C14H14A112.0°109.5°
H13C13H13A111.4°109.5°
H12C12H12A109.0°109.5°
H11C11H11A111.0°109.5°
H10C10H10A110.4°109.5°
H9C9H9A110.7°109.5°
H8C8H8A108.1°109.5°
H7C7H7A110.6°109.5°
H3C3H3A109.2°109.5°
H1C1H1A109.5°109.5°
H1C1H1B109.5°109.4°
H1AC1H1B109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C3C2C1H2120.0°120.0°
C3C2C1H2A119.3°120.0°
C2C3C4C5141.5°180.0°
C2C3C4H3120.0°120.0°
C2C3C4H3A120.1°120.0°
C3C2H2H2A119.3°120.0°
C2C3C4H498.5°60.0°
C2C3C4H4A22.3°60.0°
C2C3H3H3A120.1°120.1°
C3C2C1H164.1°180.0°
C3C2C1H1A175.9°60.0°
C3C2C1H1B55.9°60.0°
C1C2C3C428.7°180.0°
C1C2H2H2A119.4°120.0°
C1C2C3H391.3°60.1°
C1C2C3H3A148.9°60.0°
C2C1H1H1A120.0°120.0°
C2C1H1H1B120.0°120.0°
C2C1H1AH1B120.0°120.0°
C5C4C3H4120.0°120.0°
C5C4C3H4A119.3°120.0°
C4C5C6H5120.0°119.9°
C4C5C6H5A119.7°120.0°
C4C5C6C7177.5°180.0°
C5C4H4H4A119.3°120.0°
C4C5H5H5A119.7°120.0°
C4C5C6H662.5°60.0°
C4C5C6H6A56.7°60.0°
C5C4C3H398.5°60.0°
C5C4C3H3A21.4°60.0°
C3C4C5C697.4°180.0°
C4C3C2H291.3°60.0°
C4C3C2H2A148.1°60.0°
C3C4H4H4A119.3°120.0°
C3C4C5H5142.6°60.1°
C3C4C5H5A22.2°60.0°
C4C3H3H3A120.1°120.0°
C5C6C7H6120.0°120.0°
C5C6C7H6A120.7°120.0°
C5C6C7C8167.3°180.0°
C6C5C4H4142.6°60.0°
C6C5C4H4A21.8°60.0°
C6C5H5H5A119.6°120.0°
C5C6H6H6A120.7°120.0°
C5C6C7H772.7°60.1°
C5C6C7H7A47.9°60.0°
C6C7C8C9158.8°180.0°
C6C7C8H7120.0°119.9°
C6C7C8H7A119.4°120.0°
C7C6C5H557.5°60.1°
C7C6C5H5A62.9°60.0°
C7C6H6H6A120.8°120.0°
C6C7C8H838.8°60.0°
C6C7C8H8A80.5°60.0°
C6C7H7H7A119.4°120.0°
C43C42C41H42120.0°120.0°
C43C42C41H42A120.0°120.0°
C43C42C41C40179.4°180.0°
C42C43H43H43A120.0°120.0°
C42C43H43H43B120.0°120.0°
C42C43H43AH43B120.0°120.0°
C43C42H42H42A120.0°120.0°
C43C42C41H4159.4°60.0°
C43C42C41H41A61.3°60.0°
C42C41C40H41120.0°120.0°
C42C41C40H41A119.4°120.0°
C42C41C40C39131.1°180.0°
C41C42C43H43107.0°60.0°
C41C42C43H43A133.0°180.0°
C41C42C43H43B13.0°60.0°
C41C42H42H42A120.0°120.1°
C42C41H41H41A119.4°120.0°
C42C41C40H4011.1°60.0°
C42C41C40H40A108.3°60.0°
C41C40C39H40120.0°120.0°
C41C40C39H40A120.6°120.0°
C41C40C39C3887.1°180.0°
C40C41C42H4260.6°60.0°
C40C41C42H42A59.4°60.0°
C40C41H41H41A119.4°120.0°
C41C40H40H40A120.6°120.0°
C41C40C39H3932.9°60.0°
C41C40C39H39A152.6°60.0°
C40C39C38H39120.0°120.0°
C40C39C38H39A120.3°120.0°
C40C39C38C37109.7°180.0°
C39C40C41H41108.9°60.0°
C39C40C41H41A11.8°60.0°
C39C40H40H40A120.6°120.0°
C40C39H39H39A120.3°120.0°
C40C39C38H3810.3°60.0°
C40C39C38H38A131.0°60.0°
C39C38C37H38120.0°120.0°
C39C38C37H38A119.2°120.0°
C39C38C37C3636.8°180.0°
C38C39C40H40152.9°60.0°
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H11AC11C10H1020.1°60.0°
H11AC11C10H10A100.5°180.0°
H10C10C9H996.6°180.0°
H10C10C9H9A142.7°60.0°
H10AC10C9H923.9°60.0°
H10AC10C9H9A96.8°180.0°
H9C9C8H8127.4°180.0°
H9C9C8H8A8.1°60.0°
H9AC9C8H8112.0°59.9°
H9AC9C8H8A128.7°180.0°
H8C8C7H781.1°60.0°
H8C8C7H7A158.2°180.0°
H8AC8C7H7159.6°180.0°
H8AC8C7H7A38.9°60.0°
H1C1H1AH1B120.0°120.0°

218853

PDB entries from 2024-04-24

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