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EJ6

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C12C10sing1.53Å1.53Å
C7C6sing1.51Å1.50Å
C1C6doub1.38Å1.40ÅAromatic
C1C2sing1.38Å1.39ÅAromatic
C6C5sing1.38Å1.50ÅAromatic
C2C3doub1.39Å1.39ÅAromatic
C5C8sing1.51Å1.52Å
C5C4doub1.38Å1.50ÅAromatic
C3C4sing1.38Å1.49ÅAromatic
C3F9sing1.35Å1.34Å
C4C10sing1.51Å1.51Å
C10C11sing1.53Å1.53Å
C11N13sing1.46Å1.45Å
C11C14sing1.51Å1.50Å
N13S20sing1.66Å1.59Å
O22S20doub1.42Å1.43Å
C14O15sing1.35Å1.39Å
C14N18doub1.29Å1.38Å
S20O21doub1.42Å1.43Å
S20C23sing1.76Å1.59Å
O15C16sing1.34Å1.37Å
N18N17sing1.40Å1.41Å
C24C23sing1.38Å1.39ÅAromatic
C24C25doub1.38Å1.39ÅAromatic
C23C28doub1.39Å1.47ÅAromatic
C16N17sing1.35Å1.33Å
C16O19doub1.22Å1.28Å
C25C26sing1.38Å1.39ÅAromatic
C28O29sing1.36Å1.37Å
C28C27sing1.39Å1.47ÅAromatic
O29C30sing1.43Å1.43Å
C26C27doub1.39Å1.49ÅAromatic
C26CL1sing1.74Å1.80Å
C27N32sing1.40Å1.39Å
C30C31sing1.53Å1.55Å
N32C31sing1.47Å1.47Å
N32C34sing1.47Å1.46Å
C25H1sing1.08Å1.08Å
C24H2sing1.08Å1.08Å
C34H3sing1.09Å1.10Å
C34H4sing1.09Å1.10Å
C34H5sing1.09Å1.10Å
C31H6sing1.09Å1.10Å
C31H7sing1.09Å1.10Å
C30H8sing1.09Å1.10Å
C30H9sing1.09Å1.10Å
N13H10sing0.97Å1.00Å
C11H11sing1.09Å1.10Å
N17H12sing0.97Å1.00Å
C10H13sing1.09Å1.10Å
C12H14sing1.09Å1.10Å
C12H15sing1.09Å1.10Å
C12H16sing1.09Å1.10Å
C2H17sing1.08Å1.08Å
C8H18sing1.09Å1.10Å
C8H19sing1.09Å1.10Å
C8H20sing1.09Å1.10Å
C7H21sing1.09Å1.10Å
C7H22sing1.09Å1.10Å
C7H23sing1.09Å1.10Å
C1H24sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C12C10C4109.5°109.5°
C12C10C11111.0°109.5°
C12C10H13107.5°109.5°
C10C12H14109.5°109.5°
C10C12H15109.5°109.5°
C10C12H16109.4°109.5°
C7C6C1118.9°120.0°
C7C6C5120.2°120.0°
C6C7H21109.5°109.5°
C6C7H22109.5°109.5°
C6C7H23109.5°109.5°
C6C1C2121.2°120.1°
C1C6C5120.9°120.0°
C6C1H24119.4°120.0°
C1C2C3122.2°119.9°
C1C2H17118.9°120.0°
C2C1H24119.4°119.9°
C6C5C8122.0°119.9°
C6C5C4117.6°120.0°
C2C3C4121.6°119.9°
C2C3F9120.1°120.0°
C3C2H17118.9°120.0°
C8C5C4120.3°120.1°
C5C8H18109.5°109.4°
C5C8H19109.5°109.5°
C5C8H20109.5°109.4°
C5C4C3116.5°120.0°
C5C4C10122.9°120.0°
C4C3F9118.3°120.1°
C3C4C10120.6°120.0°
C4C10C11113.5°109.5°
C4C10H13107.7°109.5°
C10C11N13107.6°109.5°
C10C11C14106.1°109.4°
C10C11H11107.3°109.4°
C11C10H13107.4°109.4°
N13C11C14119.3°109.5°
C11N13S20120.9°120.0°
C11N13H10106.5°120.0°
N13C11H11108.2°109.5°
C11C14O15115.8°125.4°
C11C14N18132.2°125.3°
C14C11H11107.7°109.4°
N13S20O22112.7°106.4°
N13S20O21109.3°106.4°
N13S20C23102.0°107.2°
S20N13H10106.5°120.0°
O22S20O21109.0°123.1°
O22S20C23110.0°106.4°
O15C14N18111.7°109.3°
C14O15C16102.4°108.9°
C14N18N17105.4°107.9°
O21S20C23113.9°106.4°
S20C23C24118.5°119.9°
S20C23C28122.1°119.9°
O15C16N17113.9°107.2°
O15C16O19124.2°126.4°
N18N17C16106.6°106.7°
N18N17H12126.7°126.6°
C23C24C25122.2°120.0°
C24C23C28119.4°120.2°
C23C24H2118.9°120.0°
C24C25C26122.5°120.1°
C24C25H1118.7°119.9°
C25C24H2118.9°120.0°
C23C28O29124.0°118.7°
C23C28C27118.7°119.9°
N17C16O19122.0°126.3°
C16N17H12126.7°126.7°
C25C26C27119.0°120.3°
C25C26CL1117.6°119.8°
C26C25H1118.8°120.0°
O29C28C27117.3°121.4°
C28O29C30117.6°116.7°
C28C27C26118.2°119.5°
C28C27N32114.6°121.9°
O29C30C31114.6°107.9°
O29C30H8108.2°109.8°
O29C30H9108.2°109.9°
C27C26CL1123.4°119.9°
C26C27N32127.2°118.6°
C27N32C31117.3°112.1°
C27N32C34121.7°111.0°
C30C31N32111.4°108.6°
C30C31H6109.0°109.6°
C30C31H7109.0°109.8°
C31C30H8108.2°109.8°
C31C30H9108.2°109.7°
C31N32C34120.8°111.1°
N32C31H6109.0°109.6°
N32C31H7109.0°109.7°
N32C34H3109.5°109.5°
N32C34H4109.5°109.4°
N32C34H5109.4°109.4°
H3C34H4109.4°109.5°
H3C34H5109.5°109.6°
H4C34H5109.5°109.4°
H6C31H7109.5°109.6°
H8C30H9109.5°109.8°
H14C12H15109.5°109.4°
H14C12H16109.5°109.5°
H15C12H16109.5°109.5°
H18C8H19109.5°109.5°
H18C8H20109.5°109.4°
H19C8H20109.5°109.5°
H21C7H22109.5°109.5°
H21C7H23109.5°109.5°
H22C7H23109.4°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C12C10C4C5111.5°116.5°
C12C10C4C369.0°63.2°
C12C10C4C11124.6°120.0°
C12C10C4H13116.6°120.0°
C12C10C11H13117.2°120.0°
C12C10C11N1363.3°60.0°
C12C10C11C14167.9°180.0°
C12C10C11H1153.0°60.1°
C10C12H14H15120.0°120.0°
C10C12H14H16120.0°120.0°
C10C12H15H16120.0°120.0°
C7C6C1C5178.9°180.0°
C7C6C1C2178.6°179.8°
C7C6C5C81.5°0.0°
C7C6C5C4178.7°179.9°
C6C7H21H22120.0°120.0°
C6C7H21H23120.0°120.0°
C6C7H22H23120.0°120.0°
C7C6C1H241.4°0.0°
C6C1C2H24180.0°179.8°
C6C1C2C30.6°0.3°
C1C6C5C8179.6°180.0°
C1C6C5C40.1°0.1°
C6C1C2H17179.4°179.8°
C1C6C7H2189.4°90.0°
C1C6C7H22150.5°30.0°
C1C6C7H2330.6°150.0°
C2C1C6C50.3°0.2°
C1C2C3H17180.0°180.0°
C1C2C3C40.8°0.0°
C1C2C3F9179.7°180.0°
C6C5C8C4179.7°180.0°
C6C5C4C30.3°0.3°
C6C5C4C10179.8°180.0°
C6C5C8H1890.1°93.3°
C6C5C8H19149.9°26.7°
C6C5C8H2029.9°146.8°
C5C6C7H2189.4°90.0°
C5C6C7H2230.6°150.0°
C5C6C7H23150.6°30.0°
C5C6C1H24179.7°180.0°
C2C3C4C50.6°0.3°
C2C3C4F9179.5°180.0°
C2C3C4C10179.9°180.0°
C3C2C1H24179.4°179.9°
C8C5C4C3179.5°179.7°
C8C5C4C100.0°0.1°
C5C8H18H19120.0°120.1°
C5C8H18H20120.0°119.9°
C5C8H19H20120.0°120.0°
C5C4C3C10179.5°179.7°
C5C4C3F9179.9°179.7°
C5C4C10C11123.9°123.5°
C5C4C10H135.1°3.5°
C4C5C8H1890.1°86.7°
C4C5C8H1929.9°153.3°
C4C5C8H20149.9°33.3°
C3C4C10C1155.6°56.8°
C3C4C10H13174.4°176.8°
C4C3C2H17179.2°180.0°
F9C3C4C100.4°0.0°
F9C3C2H170.3°0.1°
C4C10C11H13119.0°120.0°
C4C10C11N13172.9°179.9°
C4C10C11C1444.1°59.9°
C4C10C11H1170.8°60.0°
C4C10C12H14180.0°60.0°
C4C10C12H1560.0°180.0°
C4C10C12H1660.0°60.0°
C10C11N13C14120.8°120.0°
C10C11N13H11115.7°120.0°
C10C11C14H11114.6°119.9°
C10C11N13S20177.6°143.3°
C10C11C14O1558.0°96.5°
C10C11C14N18114.9°83.9°
C10C11N13H1060.8°36.6°
C11C10C12H1453.9°60.0°
C11C10C12H15173.9°60.0°
C11C10C12H1666.1°180.0°
N13C11C14H11123.8°120.1°
C11N13S20H10121.6°180.0°
C11N13S20O22154.5°178.0°
N13C11C14O1563.6°143.5°
N13C11C14N18123.5°36.1°
C11N13S20O2133.2°49.1°
C11N13S20C2387.7°64.5°
N13C11C10H1353.9°60.0°
C14C11N13S2061.6°96.7°
C11C14O15N18174.3°179.7°
C11C14O15C16176.0°179.9°
C11C14N18N17175.4°179.9°
C14C11N13H1060.0°83.3°
C14C11C10H1374.9°60.0°
N13S20O22O21121.4°122.9°
N13S20O22C23113.0°114.1°
N13S20O21C23113.3°114.1°
N13S20C23C2458.4°115.2°
N13S20C23C28119.4°64.4°
S20N13C11H1161.9°23.3°
O22S20O21C23123.2°123.0°
O22S20C23C2461.3°131.2°
O22S20C23C28120.8°49.1°
O22S20N13H1083.9°2.0°
O15C14N18N172.3°0.3°
C14O15C16N170.4°0.4°
C14O15C16O19179.1°179.9°
O15C14C11H11172.6°23.4°
N18C14O15C161.7°0.4°
C14N18N17C161.9°0.0°
N18C14C11H110.3°156.2°
C14N18N17H12178.1°180.0°
O21S20C23C24176.0°1.7°
O21S20C23C281.8°178.0°
O21S20N13H10154.8°130.9°
S20C23C24C28177.9°179.7°
S20C23C24C25179.2°180.0°
S20C23C28O292.6°0.1°
S20C23C28C27179.0°179.6°
S20C23C24H20.8°0.0°
C23S20N13H1033.9°115.6°
O15C16N17N181.0°0.2°
O15C16N17O19179.5°179.8°
O15C16N17H12179.0°179.8°
N18N17C16H12180.0°180.0°
N18N17C16O19179.6°180.0°
C23C24C25H2180.0°180.0°
C23C24C25C260.8°0.0°
C24C23C28O29179.5°179.7°
C24C23C28C271.1°0.7°
C23C24C25H1179.3°179.9°
C25C24C23C281.3°0.3°
C24C25C26H1180.0°179.9°
C24C25C26C270.0°0.0°
C24C25C26CL1179.7°179.7°
C23C28O29C27178.4°179.6°
C23C28O29C30137.4°164.7°
C23C28C27C260.4°0.7°
C23C28C27N32179.0°179.1°
C28C23C24H2178.7°179.7°
O19C16N17H120.5°0.0°
C25C26C27C280.1°0.4°
C25C26C27CL1179.7°179.7°
C25C26C27N32179.5°179.4°
C26C25C24H2179.3°180.0°
O29C28C27C26179.0°179.7°
O29C28C27N320.5°0.4°
C28O29C30C3138.9°45.3°
C28O29C30H881.8°74.3°
C28O29C30H9159.6°164.9°
C27C28O29C3041.0°14.9°
C28C27C26N32179.4°179.8°
C28C27C26CL1179.6°179.9°
C28C27N32C3143.1°20.1°
C28C27N32C34133.8°104.8°
O29C30C31H8120.7°119.6°
O29C30C31H9120.7°119.7°
O29C30C31N322.1°63.3°
O29C30C31H6118.2°177.0°
O29C30C31H7122.3°56.6°
O29C30H8H9117.7°120.9°
C26C27N32C31136.3°160.1°
C26C27N32C3446.9°75.0°
C27C26C25H1180.0°179.9°
CL1C26C27N320.2°0.2°
CL1C26C25H10.3°0.4°
C27N32C31C3042.7°50.3°
C27N32C31C34176.9°124.8°
C27N32C34H3180.0°56.0°
C27N32C34H460.0°176.0°
C27N32C34H560.0°64.1°
C27N32C31H677.5°170.0°
C27N32C31H7163.0°69.6°
C30C31N32H6120.3°119.7°
C30C31N32H7120.3°119.9°
C30C31N32C34134.1°74.5°
C30C31H6H7119.2°120.5°
C31C30H8H9117.7°120.7°
C31N32C34H33.2°178.5°
C31N32C34H4116.7°58.5°
C31N32C34H5123.3°61.4°
N32C31H6H7119.1°120.4°
N32C31C30H8122.8°56.3°
N32C31C30H9118.7°177.0°
N32C34H3H4120.0°120.0°
N32C34H3H5120.0°120.0°
N32C34H4H5120.0°119.9°
C34N32C31H6105.6°45.2°
C34N32C31H713.8°165.6°
H1C25C24H20.7°0.1°
H3C34H4H5120.0°120.1°
H6C31C30H82.5°63.4°
H6C31C30H9121.1°57.3°
H7C31C30H8116.9°176.2°
H7C31C30H91.6°63.1°
H10N13C11H11176.5°156.7°
H11C11C10H13170.2°179.9°
H13C10C12H1463.2°180.0°
H13C10C12H1556.8°60.0°
H13C10C12H16176.8°60.0°
H14C12H15H16120.0°120.0°
H17C2C1H240.7°0.0°
H18C8H19H20120.0°120.0°
H21C7H22H23120.0°120.0°

248335

PDB entries from 2026-01-28

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