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YQ1

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C10C09sing0.00Å1.53Å
C08C09sing0.00Å1.53Å
C08C07sing0.00Å1.53Å
C06N01sing0.00Å1.47Å
C06C07sing0.00Å1.53Å
C01N01sing0.00Å1.47Å
C01C02sing0.00Å1.53Å
C03C02sing0.00Å1.53Å
C03C04sing0.00Å1.53Å
C05C04sing0.00Å1.53Å
C19C20sing0.00Å1.53Å
C19C18sing0.00Å1.53Å
C17C18sing0.00Å1.53Å
C17C16sing0.00Å1.53Å
C12C11sing0.00Å1.53Å
C12C13sing0.00Å1.53Å
C14C13sing0.00Å1.53Å
C14C15sing0.00Å1.53Å
N01C16sing0.00Å1.47Å
N01C11sing0.00Å1.47Å
C01H1sing0.00Å1.10Å
C01H2sing0.00Å1.10Å
C02H3sing0.00Å1.10Å
C02H4sing0.00Å1.10Å
C03H5sing0.00Å1.10Å
C03H6sing0.00Å1.10Å
C04H7sing0.00Å1.10Å
C04H8sing0.00Å1.10Å
C05H9sing0.00Å1.10Å
C05H10sing0.00Å1.10Å
C05H11sing0.00Å1.10Å
C06H12sing0.00Å1.10Å
C06H13sing0.00Å1.10Å
C07H14sing0.00Å1.10Å
C07H15sing0.00Å1.10Å
C08H16sing0.00Å1.10Å
C08H17sing0.00Å1.10Å
C09H18sing0.00Å1.10Å
C09H19sing0.00Å1.10Å
C10H20sing0.00Å1.10Å
C10H21sing0.00Å1.10Å
C10H22sing0.00Å1.10Å
C11H23sing0.00Å1.10Å
C11H24sing0.00Å1.10Å
C12H25sing0.00Å1.10Å
C12H26sing0.00Å1.10Å
C13H27sing0.00Å1.10Å
C13H28sing0.00Å1.10Å
C14H29sing0.00Å1.10Å
C14H30sing0.00Å1.10Å
C15H31sing0.00Å1.10Å
C15H32sing0.00Å1.10Å
C15H33sing0.00Å1.10Å
C16H34sing0.00Å1.10Å
C16H35sing0.00Å1.10Å
C17H36sing0.00Å1.10Å
C17H37sing0.00Å1.10Å
C18H38sing0.00Å1.10Å
C18H39sing0.00Å1.10Å
C19H40sing0.00Å1.10Å
C19H41sing0.00Å1.10Å
C20H42sing0.00Å1.10Å
C20H43sing0.00Å1.10Å
C20H44sing0.00Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C10C09C08109.5°90.0°
C10C09H18109.4°90.0°
C10C09H19109.5°90.0°
C09C10H20109.5°90.0°
C09C10H21109.5°90.0°
C09C10H22109.4°90.0°
C09C08C07109.5°90.0°
C09C08H16109.5°90.0°
C09C08H17109.5°90.0°
C08C09H18109.5°90.0°
C08C09H19109.5°90.0°
C08C07C06109.5°90.0°
C08C07H14109.5°90.0°
C08C07H15109.5°90.0°
C07C08H16109.4°90.0°
C07C08H17109.5°90.0°
N01C06C07109.4°90.0°
C06N01C01109.4°90.0°
C06N01C16109.4°90.0°
C06N01C11109.5°90.0°
N01C06H12109.5°90.0°
N01C06H13109.5°90.0°
C07C06H12109.5°90.0°
C07C06H13109.5°90.0°
C06C07H14109.4°90.0°
C06C07H15109.4°90.0°
N01C01C02109.4°90.0°
C01N01C16109.5°90.0°
C01N01C11109.5°90.0°
N01C01H1109.5°90.0°
N01C01H2109.5°90.0°
C01C02C03109.5°90.0°
C02C01H1109.5°90.0°
C02C01H2109.5°90.0°
C01C02H3109.5°90.0°
C01C02H4109.5°90.0°
C02C03C04109.4°90.0°
C03C02H3109.4°90.0°
C03C02H4109.5°90.0°
C02C03H5109.5°90.0°
C02C03H6109.5°90.0°
C03C04C05109.4°90.0°
C04C03H5109.5°90.0°
C04C03H6109.5°90.0°
C03C04H7109.5°90.0°
C03C04H8109.5°90.0°
C05C04H7109.5°90.0°
C05C04H8109.5°90.0°
C04C05H9109.5°90.0°
C04C05H10109.4°90.0°
C04C05H11109.5°90.0°
C20C19C18109.5°90.0°
C20C19H40109.4°90.0°
C20C19H41109.5°90.0°
C19C20H42109.5°90.0°
C19C20H43109.5°90.0°
C19C20H44109.4°90.0°
C19C18C17109.5°90.0°
C19C18H38109.5°90.0°
C19C18H39109.5°90.0°
C18C19H40109.4°90.0°
C18C19H41109.5°90.0°
C18C17C16109.5°90.0°
C18C17H36109.5°90.0°
C18C17H37109.5°90.0°
C17C18H38109.5°90.0°
C17C18H39109.5°90.0°
C17C16N01109.5°90.0°
C17C16H34109.5°90.0°
C17C16H35109.5°90.0°
C16C17H36109.4°90.0°
C16C17H37109.5°90.0°
C11C12C13109.5°90.0°
C12C11N01109.5°90.0°
C12C11H23109.5°90.0°
C12C11H24109.4°90.0°
C11C12H25109.4°90.0°
C11C12H26109.5°90.0°
C12C13C14109.5°90.0°
C13C12H25109.5°90.0°
C13C12H26109.5°90.0°
C12C13H27109.5°90.0°
C12C13H28109.5°90.0°
C13C14C15109.4°90.0°
C14C13H27109.5°90.0°
C14C13H28109.5°90.0°
C13C14H29109.5°90.0°
C13C14H30109.5°90.0°
C15C14H29109.5°90.0°
C15C14H30109.5°90.0°
C14C15H31109.5°90.0°
C14C15H32109.5°90.0°
C14C15H33109.5°90.0°
C16N01C11109.5°90.0°
N01C16H34109.5°90.0°
N01C16H35109.5°90.0°
N01C11H23109.5°90.0°
N01C11H24109.5°90.0°
H1C01H2109.5°90.0°
H3C02H4109.5°90.0°
H5C03H6109.4°90.0°
H7C04H8109.5°90.0°
H9C05H10109.5°90.0°
H9C05H11109.5°90.0°
H10C05H11109.5°90.0°
H12C06H13109.4°90.0°
H14C07H15109.5°90.0°
H16C08H17109.5°90.0°
H18C09H19109.5°90.0°
H20C10H21109.5°90.0°
H20C10H22109.5°90.0°
H21C10H22109.5°90.0°
H23C11H24109.5°90.0°
H25C12H26109.5°90.0°
H27C13H28109.5°90.0°
H29C14H30109.5°90.0°
H31C15H32109.5°90.0°
H31C15H33109.5°90.0°
H32C15H33109.5°90.0°
H34C16H35109.4°90.0°
H36C17H37109.5°90.0°
H38C18H39109.4°90.0°
H40C19H41109.5°90.0°
H42C20H43109.5°90.0°
H42C20H44109.5°90.0°
H43C20H44109.5°90.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C10C09C08H18120.0°90.0°
C10C09C08H19120.0°90.0°
C10C09C08C07179.9°90.0°
C10C09C08H1660.1°90.0°
C10C09C08H1759.9°90.0°
C10C09H18H19120.0°90.0°
C09C10H20H21120.0°90.0°
C09C10H20H22120.0°90.0°
C09C10H21H22120.0°90.0°
C09C08C07H16120.0°90.0°
C09C08C07H17120.0°90.0°
C09C08C07C06180.0°90.0°
C09C08C07H1460.1°90.0°
C09C08C07H1560.0°90.0°
C09C08H16H17120.0°90.0°
C08C09H18H19120.0°90.0°
C08C09C10H20180.0°90.0°
C08C09C10H2160.0°90.0°
C08C09C10H2260.0°90.0°
C08C07C06N01180.0°90.0°
C08C07C06H14120.0°90.0°
C08C07C06H15120.0°90.0°
C08C07C06H1260.0°90.0°
C08C07C06H1359.9°90.0°
C08C07H14H15120.0°90.0°
C07C08H16H17120.0°90.0°
C07C08C09H1860.0°90.0°
C07C08C09H1960.1°90.0°
N01C06C07H12120.0°90.0°
N01C06C07H13120.0°90.0°
C06N01C01C16119.9°90.0°
C06N01C01C11120.0°90.0°
C06N01C01C02180.0°90.0°
C06N01C16C1760.0°90.0°
C06N01C11C1260.0°90.0°
C06N01C16C11120.0°90.0°
C06N01C01H160.0°90.0°
C06N01C01H260.0°90.0°
N01C06H12H13120.0°90.0°
N01C06C07H1460.0°90.0°
N01C06C07H1560.0°90.0°
C06N01C11H2360.0°90.0°
C06N01C11H24180.0°90.0°
C06N01C16H34180.0°90.0°
C06N01C16H3560.1°90.0°
C07C06N01C01179.9°90.0°
C07C06N01C1660.0°90.0°
C07C06N01C1160.1°90.0°
C07C06H12H13120.0°90.0°
C06C07H14H15120.0°90.0°
C06C07C08H1660.0°90.0°
C06C07C08H1760.0°90.0°
N01C01C02H1120.0°90.0°
N01C01C02H2120.0°90.0°
N01C01C02C03180.0°90.0°
C01N01C16C1759.9°90.0°
C01N01C11C1259.9°90.0°
C01N01C16C11120.1°90.0°
N01C01H1H2120.1°90.0°
N01C01C02H360.0°90.0°
N01C01C02H460.0°90.0°
C01N01C06H1259.9°90.0°
C01N01C06H1360.0°90.0°
C01N01C11H23179.9°90.0°
C01N01C11H2460.0°90.0°
C01N01C16H3460.1°90.0°
C01N01C16H35179.9°90.0°
C01C02C03H3120.0°90.0°
C01C02C03H4120.0°90.0°
C01C02C03C04180.0°90.0°
C02C01N01C1660.1°90.0°
C02C01N01C1160.0°90.0°
C02C01H1H2120.0°90.0°
C01C02H3H4120.0°90.0°
C01C02C03H559.9°90.0°
C01C02C03H660.0°90.0°
C02C03C04H5120.0°90.0°
C02C03C04H6120.0°90.0°
C02C03C04C05180.0°90.0°
C03C02C01H160.0°90.0°
C03C02C01H260.0°90.0°
C03C02H3H4120.0°90.0°
C02C03H5H6120.0°90.0°
C02C03C04H760.1°90.0°
C02C03C04H860.0°90.0°
C03C04C05H7120.0°90.0°
C03C04C05H8120.0°90.0°
C04C03C02H360.0°90.0°
C04C03C02H459.9°90.0°
C04C03H5H6120.0°90.0°
C03C04H7H8120.1°90.0°
C03C04C05H9180.0°90.0°
C03C04C05H1060.0°90.0°
C03C04C05H1160.0°90.0°
C05C04C03H560.0°90.0°
C05C04C03H660.0°90.0°
C05C04H7H8120.0°90.0°
C04C05H9H10120.0°90.0°
C04C05H9H11120.0°90.0°
C04C05H10H11120.0°90.0°
C20C19C18H40120.0°90.0°
C20C19C18H41120.0°90.0°
C20C19C18C17179.9°90.0°
C20C19C18H3860.1°90.0°
C20C19C18H3959.9°90.0°
C20C19H40H41120.0°90.0°
C19C20H42H43120.0°90.0°
C19C20H42H44120.0°90.0°
C19C20H43H44120.0°90.0°
C19C18C17H38120.0°90.0°
C19C18C17H39120.0°90.0°
C19C18C17C16180.0°90.0°
C19C18C17H3660.1°90.0°
C19C18C17H3760.0°90.0°
C19C18H38H39120.0°90.0°
C18C19H40H41120.0°90.0°
C18C19C20H42180.0°90.0°
C18C19C20H4360.0°90.0°
C18C19C20H4460.0°90.0°
C18C17C16H36120.0°90.0°
C18C17C16H37120.0°90.0°
C18C17C16N01179.9°90.0°
C18C17C16H3459.9°90.0°
C18C17C16H3560.1°90.0°
C18C17H36H37120.0°90.0°
C17C18H38H39120.0°90.0°
C17C18C19H4060.0°90.0°
C17C18C19H4160.0°90.0°
C17C16N01H34120.0°90.0°
C17C16N01H35120.0°90.0°
C17C16N01C11180.0°90.0°
C17C16H34H35120.0°90.0°
C16C17H36H37120.0°90.0°
C16C17C18H3860.0°90.0°
C16C17C18H3960.0°90.0°
C11C12C13H25120.0°90.0°
C11C12C13H26120.0°90.0°
C11C12C13C14179.9°90.0°
C12C11N01C16180.0°90.0°
C12C11N01H23120.0°90.0°
C12C11N01H24120.0°90.0°
C12C11H23H24120.0°90.0°
C11C12H25H26120.0°90.0°
C11C12C13H2760.1°90.0°
C11C12C13H2859.9°90.0°
C12C13C14H27120.0°90.0°
C12C13C14H28120.0°90.0°
C12C13C14C15180.0°90.0°
C13C12C11N01180.0°90.0°
C13C12C11H2360.0°90.0°
C13C12C11H2460.0°90.0°
C13C12H25H26120.0°90.0°
C12C13H27H28120.0°90.0°
C12C13C14H2960.1°90.0°
C12C13C14H3060.0°90.0°
C13C14C15H29120.0°90.0°
C13C14C15H30120.0°90.0°
C14C13C12H2559.9°90.0°
C14C13C12H2660.1°90.0°
C14C13H27H28120.0°90.0°
C13C14H29H30120.0°90.0°
C13C14C15H31180.0°90.0°
C13C14C15H3260.0°90.0°
C13C14C15H3360.0°90.0°
C15C14C13H2760.0°90.0°
C15C14C13H2860.0°90.0°
C15C14H29H30120.0°90.0°
C14C15H31H32120.0°90.0°
C14C15H31H33120.0°90.0°
C14C15H32H33120.0°90.0°
C16N01C01H1180.0°90.0°
C16N01C01H259.9°90.0°
C16N01C06H1260.1°90.0°
C16N01C06H13180.0°90.0°
C16N01C11H2360.0°90.0°
C16N01C11H2460.1°90.0°
N01C16H34H35120.0°90.0°
N01C16C17H3660.1°90.0°
N01C16C17H3759.9°90.0°
C11N01C01H159.9°90.0°
C11N01C01H2180.0°90.0°
C11N01C06H12179.9°90.0°
C11N01C06H1360.0°90.0°
N01C11H23H24120.0°90.0°
N01C11C12H2560.0°90.0°
N01C11C12H2660.0°90.0°
C11N01C16H3460.0°90.0°
C11N01C16H3559.9°90.0°
H1C01C02H3180.0°90.0°
H1C01C02H460.0°90.0°
H2C01C02H360.0°90.0°
H2C01C02H4180.0°90.0°
H3C02C03H5179.9°90.0°
H3C02C03H660.0°90.0°
H4C02C03H560.1°90.0°
H4C02C03H6180.0°90.0°
H5C03C04H7179.9°90.0°
H5C03C04H860.0°90.0°
H6C03C04H760.0°90.0°
H6C03C04H8180.0°90.0°
H7C04C05H960.0°90.0°
H7C04C05H10180.0°90.0°
H7C04C05H1160.0°90.0°
H8C04C05H960.0°90.0°
H8C04C05H1060.0°90.0°
H8C04C05H11180.0°90.0°
H9C05H10H11120.0°90.0°
H12C06C07H1460.0°90.0°
H12C06C07H15180.0°90.0°
H13C06C07H14179.9°90.0°
H13C06C07H1560.0°90.0°
H14C07C08H16180.0°90.0°
H14C07C08H1759.9°90.0°
H15C07C08H1660.0°90.0°
H15C07C08H17180.0°90.0°
H16C08C09H18179.9°90.0°
H16C08C09H1959.9°90.0°
H17C08C09H1860.1°90.0°
H17C08C09H19179.9°90.0°
H18C09C10H2060.0°90.0°
H18C09C10H2160.0°90.0°
H18C09C10H22180.0°90.0°
H19C09C10H2060.0°90.0°
H19C09C10H21180.0°90.0°
H19C09C10H2260.0°90.0°
H20C10H21H22120.0°90.0°
H23C11C12H2560.0°90.0°
H23C11C12H26180.0°90.0°
H24C11C12H25180.0°90.0°
H24C11C12H2660.0°90.0°
H25C12C13H27179.9°90.0°
H25C12C13H2860.1°90.0°
H26C12C13H2759.9°90.0°
H26C12C13H28179.9°90.0°
H27C13C14H29180.0°90.0°
H27C13C14H3060.0°90.0°
H28C13C14H2959.9°90.0°
H28C13C14H30180.0°90.0°
H29C14C15H3160.0°90.0°
H29C14C15H32180.0°90.0°
H29C14C15H3360.0°90.0°
H30C14C15H3160.0°90.0°
H30C14C15H3260.0°90.0°
H30C14C15H33180.0°90.0°
H31C15H32H33120.0°90.0°
H34C16C17H36179.8°90.0°
H34C16C17H3760.1°90.0°
H35C16C17H3659.9°90.0°
H35C16C17H37179.9°90.0°
H36C17C18H38179.9°90.0°
H36C17C18H3960.0°90.0°
H37C17C18H3860.0°90.0°
H37C17C18H39180.0°90.0°
H38C18C19H40180.0°90.0°
H38C18C19H4160.0°90.0°
H39C18C19H4060.1°90.0°
H39C18C19H41180.0°90.0°
H40C19C20H4260.0°90.0°
H40C19C20H4360.0°90.0°
H40C19C20H44180.0°90.0°
H41C19C20H4260.0°90.0°
H41C19C20H43180.0°90.0°
H41C19C20H4460.0°90.0°
H42C20H43H44120.0°90.0°

222415

PDB entries from 2024-07-10

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