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EJV

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O16C14doub1.21Å1.21Å
C12C13doub1.38Å1.35ÅAromatic
C12C11sing1.40Å1.35ÅAromatic
C14O15sing1.35Å1.20Å
C14C11sing1.48Å1.51Å
C13C08sing1.38Å1.35ÅAromatic
C11C10doub1.40Å1.37ÅAromatic
C08C07sing1.51Å1.50Å
C08C09doub1.38Å1.32ÅAromatic
C10C09sing1.38Å1.37ÅAromatic
C07C06sing1.53Å1.49Å
C06C05sing1.53Å1.50Å
C05C04sing1.53Å1.50Å
C04C03sing1.53Å1.47Å
C03C02sing1.53Å1.46Å
C02C01sing1.53Å1.48Å
C10H1sing1.08Å1.08Å
C13H2sing1.08Å1.08Å
C01H3sing1.09Å1.10Å
C01H4sing1.09Å1.10Å
C01H5sing1.09Å1.10Å
C02H6sing1.09Å1.10Å
C02H7sing1.09Å1.10Å
C03H8sing1.09Å1.10Å
C03H9sing1.09Å1.10Å
C04H10sing1.09Å1.10Å
C04H11sing1.09Å1.10Å
C05H12sing1.09Å1.10Å
C05H13sing1.09Å1.10Å
C06H14sing1.09Å1.10Å
C06H15sing1.09Å1.10Å
C07H16sing1.09Å1.10Å
C07H17sing1.09Å1.10Å
C09H18sing1.08Å1.08Å
C12H19sing1.08Å1.08Å
O15H20sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O16C14O15121.6°120.0°
O16C14C11120.2°120.0°
C13C12C11121.0°119.9°
C12C13C08123.7°120.1°
C12C13H2118.1°119.9°
C13C12H19119.5°120.1°
C12C11C14119.0°120.2°
C12C11C10115.4°119.7°
C11C12H19119.5°120.0°
O15C14C11118.1°120.0°
C14O15H20109.5°117.0°
C14C11C10125.6°120.1°
C13C08C07121.6°119.8°
C13C08C09115.4°120.3°
C08C13H2118.1°119.9°
C11C10C09122.0°119.9°
C11C10H1119.0°120.1°
C07C08C09123.0°119.8°
C08C07C06113.3°109.5°
C08C07H16108.5°109.5°
C08C07H17108.5°109.5°
C08C09C10122.5°120.1°
C08C09H18118.8°119.9°
C09C10H1119.0°120.0°
C10C09H18118.8°120.0°
C07C06C05110.7°109.5°
C07C06H14109.2°109.4°
C07C06H15109.1°109.5°
C06C07H16108.5°109.5°
C06C07H17108.5°109.5°
C06C05C04115.7°109.5°
C06C05H12107.9°109.5°
C06C05H13107.9°109.5°
C05C06H14109.2°109.5°
C05C06H15109.2°109.5°
C05C04C03112.8°109.5°
C05C04H10108.6°109.4°
C05C04H11108.6°109.5°
C04C05H12107.9°109.5°
C04C05H13107.9°109.5°
C04C03C02114.3°109.4°
C04C03H8108.2°109.4°
C04C03H9108.3°109.5°
C03C04H10108.6°109.5°
C03C04H11108.6°109.5°
C03C02C01110.2°109.5°
C03C02H6109.3°109.5°
C03C02H7109.3°109.5°
C02C03H8108.3°109.5°
C02C03H9108.3°109.5°
C02C01H3109.5°109.5°
C02C01H4109.4°109.5°
C02C01H5109.5°109.4°
C01C02H6109.3°109.5°
C01C02H7109.3°109.5°
H3C01H4109.5°109.5°
H3C01H5109.5°109.5°
H4C01H5109.5°109.5°
H6C02H7109.5°109.4°
H8C03H9109.5°109.5°
H10C04H11109.5°109.5°
H12C05H13109.5°109.5°
H14C06H15109.5°109.5°
H16C07H17109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O16C14C11C128.3°179.9°
O16C14O15C11178.4°180.0°
O16C14C11C10172.3°0.0°
O16C14O15H200.0°0.0°
C13C12C11H19180.0°179.8°
C13C12C11C14179.5°180.0°
C12C13C08H2180.0°179.4°
C13C12C11C101.0°0.0°
C12C13C08C07178.4°179.5°
C12C13C08C092.5°0.5°
C12C11C14O15170.1°0.0°
C12C11C14C10179.4°179.9°
C11C12C13C082.3°0.3°
C12C11C10C090.1°0.1°
C12C11C10H1179.9°179.8°
C11C12C13H2177.7°179.7°
O15C14C11C109.3°180.0°
C14C11C10C09179.5°180.0°
C14C11C10H10.5°0.2°
C14C11C12H190.5°0.2°
C11C14O15H20178.4°180.0°
C13C08C07C09179.0°180.0°
C13C08C09C101.6°0.5°
C13C08C07C0664.0°90.0°
C13C08C07H1656.5°30.0°
C13C08C07H17175.4°150.0°
C13C08C09H18178.4°179.5°
C08C13C12H19177.7°179.9°
C11C10C09C080.5°0.2°
C11C10C09H1180.0°179.8°
C11C10C09H18179.5°179.8°
C10C11C12H19179.0°179.8°
C07C08C09C10179.3°179.5°
C08C07C06H16120.6°120.0°
C08C07C06H17120.5°120.0°
C08C07C06C0576.2°180.0°
C07C08C13H21.6°0.1°
C08C07C06H1444.1°60.0°
C08C07C06H15163.7°60.0°
C08C07H16H17118.3°120.0°
C07C08C09H180.7°0.5°
C08C09C10H18180.0°180.0°
C09C08C07C06115.0°90.0°
C08C09C10H1179.5°180.0°
C09C08C13H2177.5°179.9°
C09C08C07H16124.4°150.0°
C09C08C07H175.6°30.0°
C07C06C05H14120.2°120.0°
C07C06C05H15120.2°120.0°
C07C06C05C04167.0°180.0°
C07C06C05H1272.1°60.0°
C07C06C05H1346.1°60.0°
C07C06H14H15119.4°120.0°
C06C07H16H17118.3°120.0°
C06C05C04H12120.9°120.1°
C06C05C04H13120.9°120.0°
C06C05C04C03152.2°180.0°
C06C05C04H1031.7°60.0°
C06C05C04H1187.3°60.0°
C06C05H12H13117.2°120.0°
C05C06H14H15119.4°120.0°
C05C06C07H16163.3°59.9°
C05C06C07H1744.4°60.0°
C05C04C03H10120.5°120.0°
C05C04C03H11120.5°120.0°
C05C04C03C02103.1°180.0°
C05C04C03H817.6°60.0°
C05C04C03H9136.2°60.0°
C05C04H10H11118.5°120.0°
C04C05H12H13117.2°120.0°
C04C05C06H1446.8°60.0°
C04C05C06H1572.8°60.0°
C04C03C02H8120.7°119.9°
C04C03C02H9120.7°120.0°
C04C03C02C0164.2°180.0°
C04C03C02H6175.6°60.0°
C04C03C02H755.9°60.0°
C04C03H8H9117.8°120.0°
C03C04H10H11118.5°120.0°
C03C04C05H1286.9°60.0°
C03C04C05H1331.3°60.0°
C03C02C01H6120.1°120.0°
C03C02C01H7120.1°120.1°
C03C02C01H3180.0°180.0°
C03C02C01H460.0°59.9°
C03C02C01H560.0°60.1°
C03C02H6H7119.6°120.0°
C02C03H8H9117.8°120.0°
C02C03C04H10136.4°60.1°
C02C03C04H1117.4°60.0°
C02C01H3H4120.0°120.0°
C02C01H3H5120.0°119.9°
C02C01H4H5120.0°119.9°
C01C02H6H7119.7°120.0°
C01C02C03H856.4°60.1°
C01C02C03H9175.1°60.0°
H1C10C09H180.5°0.0°
H2C13C12H192.3°0.5°
H3C01H4H5120.0°120.0°
H3C01C02H659.9°60.0°
H3C01C02H759.9°60.0°
H4C01C02H6179.9°60.0°
H4C01C02H760.1°180.0°
H5C01C02H660.1°180.0°
H5C01C02H7179.9°60.0°
H6C02C03H863.7°179.9°
H6C02C03H955.0°60.0°
H7C02C03H8176.5°60.0°
H7C02C03H964.8°180.0°
H8C03C04H10102.9°180.0°
H8C03C04H11138.1°60.0°
H9C03C04H1015.7°59.9°
H9C03C04H11103.3°180.0°
H10C04C05H12152.6°180.0°
H10C04C05H1389.2°60.0°
H11C04C05H1233.6°60.1°
H11C04C05H13151.8°180.0°
H12C05C06H14167.7°180.0°
H12C05C06H1548.1°60.0°
H13C05C06H1474.1°59.9°
H13C05C06H15166.3°180.0°
H14C06C07H1676.5°180.0°
H14C06C07H17164.6°60.0°
H15C06C07H1643.1°60.0°
H15C06C07H1775.8°180.0°

225946

PDB entries from 2024-10-09

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