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VGJ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O1C15sing1.34Å1.27Å
C15O2doub1.21Å1.26Å
C15C14sing1.51Å1.55Å
C14C13sing1.53Å1.57Å
C13C16sing1.53Å1.54Å
C13C12sing1.53Å1.56Å
C12C11sing1.53Å1.56Å
C11C10sing1.53Å1.55Å
C10C9sing1.53Å1.55Å
C9C17sing1.53Å1.53Å
C9C8sing1.53Å1.54Å
C8C7sing1.53Å1.55Å
C7C6sing1.53Å1.55Å
C6C5sing1.53Å1.54Å
C5C18sing1.53Å1.51Å
C5C4sing1.53Å1.53Å
C4C3sing1.53Å1.53Å
C3C2sing1.53Å1.53Å
C2C1sing1.53Å1.51Å
C1C19sing1.53Å1.52Å
C1C20sing1.53Å1.53Å
O1H1sing0.97Å0.95Å
C14H141sing1.09Å1.10Å
C14H142sing1.09Å1.10Å
C13H13sing1.09Å1.10Å
C16H161sing1.09Å1.10Å
C16H162sing1.09Å1.10Å
C16H163sing1.09Å1.10Å
C12H121sing1.09Å1.10Å
C12H122sing1.09Å1.10Å
C11H111sing1.09Å1.10Å
C11H112sing1.09Å1.10Å
C10H101sing1.09Å1.10Å
C10H102sing1.09Å1.10Å
C9H9sing1.09Å1.10Å
C17H171sing1.09Å1.10Å
C17H172sing1.09Å1.10Å
C17H173sing1.09Å1.10Å
C8H81Csing1.09Å1.10Å
C8H82Csing1.09Å1.10Å
C7H71Csing1.09Å1.10Å
C7H72Csing1.09Å1.10Å
C6H61Csing1.09Å1.10Å
C6H62Csing1.09Å1.10Å
C5H5sing1.09Å1.10Å
C18H181sing1.09Å1.10Å
C18H182sing1.09Å1.10Å
C18H183sing1.09Å1.10Å
C4H41Csing1.09Å1.10Å
C4H42Csing1.09Å1.10Å
C3H31Csing1.09Å1.10Å
C3H32Csing1.09Å1.10Å
C2H21Csing1.09Å1.10Å
C2H22Csing1.09Å1.10Å
C1HAsing1.09Å1.10Å
C19H191sing1.09Å1.10Å
C19H192sing1.09Å1.10Å
C19H193sing1.09Å1.10Å
C20H201sing1.09Å1.10Å
C20H202sing1.09Å1.10Å
C20H203sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1C15O2119.4°120.0°
O1C15C14121.7°120.0°
C15O1H1109.5°117.0°
O2C15C14118.9°120.0°
C15C14C13119.2°109.5°
C15C14H141106.4°109.5°
C15C14H142104.1°109.4°
C14C13C16113.2°109.5°
C14C13C12115.1°109.5°
C13C14H141106.4°109.5°
C13C14H142104.1°109.5°
C14C13H13103.1°109.5°
C16C13C12111.2°109.5°
C16C13H13107.8°109.4°
C13C16H161109.5°109.4°
C13C16H162109.5°109.5°
C13C16H163109.4°109.5°
C13C12C11117.4°109.4°
C12C13H13105.6°109.4°
C13C12H121106.9°109.5°
C13C12H122105.1°109.4°
C12C11C10119.4°109.4°
C11C12H121106.9°109.5°
C11C12H122105.1°109.5°
C12C11H111106.3°109.5°
C12C11H112104.0°109.5°
C11C10C9115.7°109.5°
C10C11H111106.3°109.5°
C10C11H112104.0°109.5°
C11C10H101107.4°109.5°
C11C10H102106.0°109.4°
C10C9C17113.6°109.5°
C10C9C8110.8°109.5°
C9C10H101107.4°109.5°
C9C10H102106.0°109.5°
C10C9H9106.3°109.5°
C17C9C8111.5°109.5°
C17C9H9105.5°109.5°
C9C17H171109.5°109.5°
C9C17H172109.5°109.5°
C9C17H173109.5°109.5°
C9C8C7118.3°109.5°
C8C9H9108.7°109.4°
C9C8H81C106.6°109.5°
C9C8H82C104.6°109.4°
C8C7C6112.9°109.5°
C7C8H81C106.6°109.5°
C7C8H82C104.6°109.5°
C8C7H71C108.3°109.5°
C8C7H72C107.6°109.5°
C7C6C5119.5°109.5°
C6C7H71C108.3°109.5°
C6C7H72C107.6°109.5°
C7C6H61C106.2°109.4°
C7C6H62C103.9°109.5°
C6C5C18112.6°109.4°
C6C5C4114.2°109.5°
C5C6H61C106.3°109.5°
C5C6H62C103.9°109.5°
C6C5H5102.0°109.5°
C18C5C4102.3°109.5°
C18C5H5113.9°109.5°
C5C18H181109.5°109.5°
C5C18H182109.4°109.5°
C5C18H183109.5°109.5°
C5C4C3121.1°109.5°
C4C5H5112.3°109.5°
C5C4H41C105.8°109.5°
C5C4H42C103.0°109.5°
C4C3C2109.3°109.5°
C3C4H41C105.7°109.5°
C3C4H42C103.1°109.5°
C4C3H31C109.5°109.5°
C4C3H32C109.6°109.5°
C3C2C1113.2°109.5°
C2C3H31C109.5°109.5°
C2C3H32C109.6°109.5°
C3C2H21C108.2°109.5°
C3C2H22C107.4°109.5°
C2C1C19111.4°109.5°
C2C1C20112.3°109.5°
C1C2H21C108.2°109.5°
C1C2H22C107.4°109.5°
C2C1HA107.3°109.4°
C19C1C20112.7°109.5°
C19C1HA106.8°109.5°
C1C19H191109.5°109.4°
C1C19H192109.4°109.5°
C1C19H193109.5°109.5°
C20C1HA105.8°109.4°
C1C20H201109.5°109.5°
C1C20H202109.5°109.4°
C1C20H203109.5°109.4°
H141C14H142117.4°109.5°
H161C16H162109.5°109.4°
H161C16H163109.5°109.5°
H162C16H163109.5°109.5°
H121C12H122115.9°109.5°
H111C11H112117.6°109.5°
H101C10H102114.5°109.5°
H171C17H172109.5°109.5°
H171C17H173109.4°109.5°
H172C17H173109.5°109.4°
H81CC8H82C116.7°109.5°
H71CC7H72C112.2°109.5°
H61CC6H62C117.7°109.4°
H181C18H182109.4°109.5°
H181C18H183109.4°109.4°
H182C18H183109.5°109.5°
H41CC4H42C119.1°109.5°
H31CC3H32C109.3°109.5°
H21CC2H22C112.5°109.5°
H191C19H192109.4°109.5°
H191C19H193109.5°109.5°
H192C19H193109.5°109.5°
H201C20H202109.5°109.5°
H201C20H203109.5°109.5°
H202C20H203109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1C15O2C14178.3°179.9°
O1C15C14C13117.7°180.0°
O1C15C14H1412.3°60.0°
O1C15C14H142127.0°60.0°
O2C15C14C1364.0°0.1°
O2C15O1H10.0°0.0°
O2C15C14H141175.9°120.0°
O2C15C14H14251.3°120.0°
C15C14C13H141120.0°120.0°
C15C14C13H142115.4°120.0°
C15C14C13C1647.2°64.9°
C15C14C13C12176.6°175.0°
C14C15O1H1178.3°180.0°
C15C14H141H142116.0°120.0°
C15C14C13H1369.0°55.0°
C14C13C16C12131.4°120.0°
C14C13C16H13113.4°120.0°
C14C13C12H13113.0°120.0°
C14C13C12C11121.9°175.0°
C13C14H141H142116.0°120.0°
C14C13C16H16179.6°60.0°
C14C13C16H16240.4°59.9°
C14C13C16H163160.4°180.0°
C14C13C12H121118.1°55.0°
C14C13C12H1225.5°65.0°
C16C13C12H13116.6°119.9°
C16C13C12C118.6°65.0°
C16C13C14H141167.2°175.0°
C16C13C14H14268.1°55.0°
C13C16H161H162120.0°119.9°
C13C16H161H163120.0°120.0°
C13C16H162H163120.0°120.1°
C16C13C12H121111.4°175.0°
C16C13C12H122124.9°55.1°
C13C12C11H121120.0°120.0°
C13C12C11H122116.3°120.0°
C13C12C11C10153.8°180.0°
C12C13C14H14163.3°55.0°
C12C13C14H14261.3°65.0°
C12C13C16H16151.8°60.0°
C12C13C16H162171.8°180.0°
C12C13C16H16368.2°60.0°
C13C12H121H122116.8°120.0°
C13C12C11H11186.2°60.0°
C13C12C11H11238.6°60.0°
C12C11C10H111120.0°120.0°
C12C11C10H112115.2°120.0°
C12C11C10C9107.0°180.0°
C11C12C13H13125.1°55.0°
C11C12H121H122116.8°120.1°
C12C11H111H112115.9°120.0°
C12C11C10H101133.0°60.0°
C12C11C10H10210.2°60.0°
C11C10C9H101120.0°120.0°
C11C10C9H102117.1°120.0°
C11C10C9C1780.4°65.0°
C11C10C9C8153.1°175.0°
C10C11C12H12133.8°60.0°
C10C11C12H12289.9°60.0°
C10C11H111H112115.9°120.0°
C11C10H101H102117.5°120.0°
C11C10C9H935.2°55.0°
C10C9C17C8126.1°120.0°
C10C9C17H9116.1°120.0°
C10C9C8H9116.5°120.0°
C10C9C8C7171.2°175.0°
C9C10C11H11113.0°60.0°
C9C10C11H112137.8°60.0°
C9C10H101H102117.4°120.0°
C10C9C17H171167.4°180.0°
C10C9C17H17247.4°60.0°
C10C9C17H17372.6°60.0°
C10C9C8H81C68.8°65.0°
C10C9C8H82C55.4°55.0°
C17C9C8H9115.9°120.0°
C17C9C8C761.1°65.0°
C17C9C10H10139.6°55.0°
C17C9C10H102162.5°175.0°
C9C17H171H172120.0°120.0°
C9C17H171H173120.0°120.0°
C9C17H172H173120.0°120.0°
C17C9C8H81C58.9°55.0°
C17C9C8H82C176.9°175.0°
C9C8C7H81C120.0°120.0°
C9C8C7H82C115.8°120.0°
C9C8C7C6148.7°180.0°
C8C9C10H10186.9°65.0°
C8C9C10H10236.0°55.0°
C8C9C17H17166.5°60.0°
C8C9C17H172173.5°180.0°
C8C9C17H17353.5°60.0°
C9C8H81CH82C116.3°120.0°
C9C8C7H71C28.7°60.0°
C9C8C7H72C92.8°59.9°
C8C7C6H71C120.0°120.0°
C8C7C6H72C118.5°120.0°
C8C7C6C5131.7°180.0°
C7C8C9H954.8°55.0°
C7C8H81CH82C116.4°120.0°
C8C7H71CH72C118.6°120.0°
C8C7C6H61C11.7°60.0°
C8C7C6H62C113.1°60.0°
C7C6C5H61C120.0°120.0°
C7C6C5H62C115.2°120.0°
C7C6C5C1838.2°65.0°
C7C6C5C4154.3°175.0°
C6C7C8H81C91.3°60.0°
C6C7C8H82C32.9°60.0°
C6C7H71CH72C118.6°120.0°
C7C6H61CH62C115.9°119.9°
C7C6C5H584.2°55.0°
C6C5C18C4123.0°120.0°
C6C5C18H5115.5°120.0°
C6C5C4H5115.5°120.0°
C6C5C4C338.3°175.0°
C5C6C7H71C108.3°60.0°
C5C6C7H72C13.2°60.0°
C5C6H61CH62C115.9°120.0°
C6C5C18H181129.2°180.0°
C6C5C18H1829.2°60.0°
C6C5C18H183110.8°60.0°
C6C5C4H41C158.3°65.0°
C6C5C4H42C75.9°55.0°
C18C5C4H5122.6°120.0°
C18C5C4C3160.2°65.0°
C18C5C6H61C81.7°55.0°
C18C5C6H62C153.4°175.0°
C5C18H181H182120.0°120.0°
C5C18H181H183120.0°120.0°
C5C18H182H183120.0°120.0°
C18C5C4H41C79.8°55.0°
C18C5C4H42C46.0°175.0°
C5C4C3H41C120.0°120.0°
C5C4C3H42C114.2°120.0°
C5C4C3C2158.0°180.0°
C4C5C6H61C34.4°65.0°
C4C5C6H62C90.5°55.0°
C4C5C18H181107.8°60.0°
C4C5C18H182132.2°180.0°
C4C5C18H18312.2°60.0°
C5C4H41CH42C115.2°120.0°
C5C4C3H31C82.0°60.0°
C5C4C3H32C37.9°60.0°
C4C3C2H31C120.0°120.0°
C4C3C2H32C120.1°120.0°
C4C3C2C1170.4°180.0°
C3C4C5H577.2°55.0°
C3C4H41CH42C115.2°120.0°
C4C3H31CH32C120.1°120.0°
C4C3C2H21C69.6°60.0°
C4C3C2H22C52.0°60.0°
C3C2C1H21C120.0°120.0°
C3C2C1H22C118.4°120.0°
C3C2C1C1979.3°65.0°
C3C2C1C20153.1°175.0°
C2C3C4H41C38.0°60.0°
C2C3C4H42C87.8°60.0°
C2C3H31CH32C120.1°120.0°
C3C2H21CH22C118.5°120.0°
C3C2C1HA37.3°55.1°
C2C1C19C20127.4°120.0°
C2C1C19HA116.9°120.0°
C2C1C20HA116.7°119.9°
C1C2C3H31C50.4°60.0°
C1C2C3H32C69.5°60.0°
C1C2H21CH22C118.5°120.0°
C2C1C19H19110.8°60.0°
C2C1C19H192130.7°180.0°
C2C1C19H193109.2°60.0°
C2C1C20H201156.9°60.0°
C2C1C20H20283.1°180.0°
C2C1C20H20336.9°60.1°
C19C1C20HA116.4°120.0°
C19C1C2H21C160.7°55.0°
C19C1C2H22C39.1°175.0°
C1C19H191H192120.0°120.0°
C1C19H191H193120.0°120.0°
C1C19H192H193120.0°120.0°
C19C1C20H20130.0°180.0°
C19C1C20H202150.0°60.0°
C19C1C20H20390.0°60.0°
C20C1C2H21C33.1°65.0°
C20C1C2H22C88.5°55.0°
C20C1C19H191138.2°60.0°
C20C1C19H192101.9°60.0°
C20C1C19H19318.2°180.0°
C1C20H201H202120.0°120.0°
C1C20H201H203120.0°120.0°
C1C20H202H203120.0°120.0°
H141C14C13H1351.1°65.0°
H142C14C13H13175.7°175.0°
H13C13C16H161167.0°NaN°
H13C13C16H16273.0°60.1°
H13C13C16H16347.0°60.0°
H13C13C12H1215.1°65.0°
H13C13C12H122118.5°175.0°
H161C16H162H163120.0°120.0°
H121C12C11H111153.8°180.0°
H121C12C11H11281.4°60.0°
H122C12C11H11130.1°60.0°
H122C12C11H112154.9°180.0°
H111C11C10H101107.0°180.0°
H111C11C10H102130.1°60.0°
H112C11C10H10117.8°60.0°
H112C11C10H102105.1°180.0°
H101C10C9H9155.2°175.0°
H102C10C9H981.9°65.0°
H9C9C17H17151.3°60.0°
H9C9C17H17268.7°60.0°
H9C9C17H173171.3°180.0°
H9C9C8H81C174.8°175.0°
H9C9C8H82C61.0°65.0°
H171C17H172H173120.0°120.0°
H81CC8C7H71C148.7°180.0°
H81CC8C7H72C27.2°60.0°
H82CC8C7H71C87.1°59.9°
H82CC8C7H72C151.4°179.9°
H71CC7C6H61C131.7°179.9°
H71CC7C6H62C6.8°60.0°
H72CC7C6H61C106.8°60.1°
H72CC7C6H62C128.3°180.0°
H61CC6C5H5155.8°175.0°
H62CC6C5H530.9°65.0°
H5C5C18H18113.7°60.0°
H5C5C18H182106.3°60.0°
H5C5C18H183133.7°180.0°
H5C5C4H41C42.8°175.0°
H5C5C4H42C168.6°65.0°
H181C18H182H183120.0°120.0°
H41CC4C3H31C158.0°180.0°
H41CC4C3H32C82.0°60.0°
H42CC4C3H31C32.2°60.0°
H42CC4C3H32C152.2°180.0°
H31CC3C2H21C170.4°180.0°
H31CC3C2H22C67.9°60.0°
H32CC3C2H21C50.5°60.0°
H32CC3C2H22C172.1°180.0°
H21CC2C1HA82.7°175.0°
H22CC2C1HA155.6°64.9°
HAC1C19H191106.1°180.0°
HAC1C19H19213.9°60.0°
HAC1C19H193133.9°60.0°
HAC1C20H20186.4°59.9°
HAC1C20H20233.6°60.0°
HAC1C20H203153.6°180.0°
H191C19H192H193120.0°120.0°
H201C20H202H203120.0°120.1°

223532

PDB entries from 2024-08-07

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