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YT1

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C13C14sing1.53Å1.53Å
C13C12sing1.53Å1.52Å
C14C15sing1.53Å1.52Å
C19C18sing1.53Å1.52Å
C19Nsing1.47Å1.47Å
C18N1sing1.47Å1.47Å
N1C12sing1.47Å1.47Å
N1C11sing1.47Å1.47Å
C9Nsing1.47Å1.47Å
C9C8sing1.53Å1.52Å
C12C17sing1.53Å1.52Å
NC10sing1.47Å1.47Å
C10C11sing1.53Å1.51Å
C22C21doub1.38Å1.38ÅAromatic
C22C23sing1.38Å1.38ÅAromatic
C15C16sing1.53Å1.52Å
C7C8sing1.53Å1.52Å
C7C6sing1.53Å1.54Å
C21C20sing1.39Å1.39ÅAromatic
C23C1doub1.39Å1.39ÅAromatic
C17C16sing1.53Å1.52Å
C20C6sing1.51Å1.52Å
C20C2doub1.38Å1.41ÅAromatic
C1C2sing1.39Å1.40ÅAromatic
C1Osing1.36Å1.37Å
COsing1.43Å1.43Å
C6C5sing1.53Å1.53Å
C2C3sing1.51Å1.51Å
C5C4sing1.53Å1.52Å
C3C4sing1.53Å1.51Å
C4H1sing1.09Å1.10Å
C4H2sing1.09Å1.10Å
C14H3sing1.09Å1.10Å
C14H4sing1.09Å1.10Å
C5H5sing1.09Å1.10Å
C5H6sing1.09Å1.10Å
C6H7sing1.09Å1.10Å
C11H8sing1.09Å1.10Å
C11H9sing1.09Å1.10Å
C7H10sing1.09Å1.10Å
C7H11sing1.09Å1.10Å
C8H12sing1.09Å1.10Å
C8H13sing1.09Å1.10Å
C9H14sing1.09Å1.10Å
C9H15sing1.09Å1.10Å
C10H16sing1.09Å1.10Å
C10H17sing1.09Å1.10Å
C12H18sing1.09Å1.10Å
C13H19sing1.09Å1.10Å
C13H20sing1.09Å1.10Å
C3H22sing1.09Å1.10Å
C3H23sing1.09Å1.10Å
CH25sing1.09Å1.10Å
CH26sing1.09Å1.10Å
CH27sing1.09Å1.10Å
C15H28sing1.09Å1.10Å
C15H29sing1.09Å1.10Å
C16H30sing1.09Å1.10Å
C16H31sing1.09Å1.10Å
C17H32sing1.09Å1.10Å
C17H33sing1.09Å1.10Å
C18H34sing1.09Å1.10Å
C18H35sing1.09Å1.10Å
C19H36sing1.09Å1.10Å
C19H37sing1.09Å1.10Å
C21H38sing1.08Å1.08Å
C22H39sing1.08Å1.08Å
C23H40sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C14C13C12110.3°109.5°
C13C14C15111.2°109.5°
C13C14H3109.1°109.4°
C13C14H4109.0°109.5°
C14C13H19109.2°109.4°
C14C13H20109.3°109.5°
C13C12N1114.3°109.4°
C13C12C17110.8°109.5°
C13C12H18105.0°109.5°
C12C13H19109.3°109.5°
C12C13H20109.3°109.5°
C14C15C16110.9°109.5°
C15C14H3109.0°109.4°
C15C14H4109.0°109.5°
C14C15H28109.1°109.5°
C14C15H29109.1°109.4°
C18C19N110.7°109.4°
C19C18N1109.7°109.3°
C19C18H34109.4°109.4°
C19C18H35109.4°109.6°
C18C19H36109.2°109.5°
C18C19H37109.2°109.5°
C19NC9111.2°111.0°
C19NC10109.4°110.9°
NC19H36109.2°109.5°
NC19H37109.2°109.5°
C18N1C12113.8°111.0°
C18N1C11108.7°110.9°
N1C18H34109.4°109.5°
N1C18H35109.4°109.5°
C12N1C11112.9°111.0°
N1C12C17115.0°109.4°
N1C12H18105.6°109.5°
N1C11C10109.8°109.4°
N1C11H8109.4°109.5°
N1C11H9109.4°109.5°
NC9C8113.1°109.5°
C9NC10110.4°111.0°
NC9H14108.5°109.5°
NC9H15108.6°109.5°
C9C8C7114.9°109.5°
C9C8H12108.1°109.5°
C9C8H13108.1°109.5°
C8C9H14108.5°109.4°
C8C9H15108.5°109.5°
C12C17C16110.2°109.5°
C17C12H18105.1°109.5°
C12C17H32109.3°109.5°
C12C17H33109.3°109.5°
NC10C11110.8°109.4°
NC10H16109.2°109.5°
NC10H17109.1°109.5°
C10C11H8109.4°109.5°
C10C11H9109.4°109.5°
C11C10H16109.2°109.5°
C11C10H17109.2°109.5°
C21C22C23120.6°119.8°
C22C21C20120.8°120.7°
C22C21H38119.6°119.6°
C21C22H39119.7°120.1°
C22C23C1119.4°119.8°
C23C22H39119.7°120.1°
C22C23H40120.3°120.1°
C15C16C17111.1°109.5°
C16C15H28109.1°109.5°
C16C15H29109.1°109.5°
C15C16H30109.1°109.5°
C15C16H31109.1°109.5°
C8C7C6114.6°109.5°
C8C7H10108.2°109.5°
C8C7H11108.2°109.4°
C7C8H12108.1°109.5°
C7C8H13108.1°109.5°
C7C6C20111.7°109.2°
C7C6C5108.7°109.2°
C7C6H7107.9°109.3°
C6C7H10108.2°109.5°
C6C7H11108.2°109.5°
C21C20C6119.8°117.8°
C21C20C2119.2°119.7°
C20C21H38119.6°119.7°
C23C1C2120.9°120.3°
C23C1O124.0°119.9°
C1C23H40120.3°120.0°
C17C16H30109.1°109.4°
C17C16H31109.1°109.5°
C16C17H32109.3°109.5°
C16C17H33109.3°109.5°
C6C20C2121.0°122.5°
C20C6C5112.1°110.6°
C20C6H7108.2°109.3°
C20C2C1119.2°119.7°
C20C2C3122.2°122.6°
C2C1O115.1°119.8°
C1C2C3118.6°117.7°
C1OC117.5°117.0°
OCH25109.5°109.5°
OCH26109.4°109.5°
OCH27109.4°109.5°
C6C5C4111.3°108.4°
C6C5H5109.0°109.7°
C6C5H6109.0°109.7°
C5C6H7108.1°109.2°
C2C3C4113.2°110.6°
C2C3H22108.5°109.3°
C2C3H23108.5°109.3°
C5C4C3110.0°108.4°
C5C4H1109.3°109.7°
C5C4H2109.3°109.7°
C4C5H5109.0°109.7°
C4C5H6109.0°109.7°
C3C4H1109.4°109.7°
C3C4H2109.3°109.7°
C4C3H22108.6°109.2°
C4C3H23108.5°109.3°
H1C4H2109.5°109.7°
H3C14H4109.5°109.4°
H5C5H6109.5°109.6°
H8C11H9109.5°109.5°
H10C7H11109.5°109.5°
H12C8H13109.5°109.4°
H14C9H15109.5°109.4°
H16C10H17109.4°109.4°
H19C13H20109.4°109.5°
H22C3H23109.5°109.2°
H25CH26109.4°109.5°
H25CH27109.5°109.4°
H26CH27109.5°109.5°
H28C15H29109.5°109.5°
H30C16H31109.5°109.5°
H32C17H33109.4°109.5°
H34C18H35109.4°109.5°
H36C19H37109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C14C13C12H19120.1°119.9°
C14C13C12H20120.1°120.0°
C13C14C15H3120.3°120.0°
C13C14C15H4120.2°120.1°
C14C13C12N1170.8°179.9°
C14C13C12C1757.3°60.0°
C13C14C15C1655.9°60.0°
C13C14H3H4119.2°120.0°
C14C13C12H1855.6°60.0°
C14C13H19H20119.6°120.0°
C13C14C15H28176.1°180.0°
C13C14C15H2964.3°60.0°
C12C13C14C1556.5°59.9°
C13C12N1C1850.5°176.2°
C13C12N1C17129.8°120.0°
C13C12N1H18114.9°120.0°
C13C12N1C11175.0°60.0°
C13C12C17H18112.9°120.0°
C13C12C17C1657.5°60.0°
C12C13C14H363.8°60.0°
C12C13C14H4176.7°180.0°
C12C13H19H20119.6°120.1°
C13C12C17H3262.6°60.0°
C13C12C17H33177.6°180.0°
C14C15C16H28120.2°120.0°
C14C15C16H29120.2°120.0°
C14C15C16C1756.1°60.0°
C15C14H3H4119.2°120.0°
C15C14C13H1963.7°60.0°
C15C14C13H20176.6°180.0°
C14C15H28H29119.3°119.9°
C14C15C16H3064.1°60.0°
C14C15C16H31176.4°180.0°
C18C19NH36120.2°120.0°
C18C19NH37120.2°120.0°
C19C18N1H34120.0°119.9°
C19C18N1H35120.0°120.0°
C19C18N1C12172.8°176.9°
C19C18N1C1160.4°59.3°
C18C19NC9179.4°176.8°
C18C19NC1057.2°59.3°
C19C18H34H35119.9°120.1°
C18C19H36H37119.4°120.0°
NC19C18N159.5°58.4°
C19NC9C10121.6°123.8°
C19NC9C8158.8°66.2°
C19NC10C1157.2°59.3°
C19NC9H1438.3°173.8°
C19NC9H1580.6°53.8°
C19NC10H16177.4°60.7°
C19NC10H1763.0°179.3°
NC19C18H34179.5°61.5°
NC19C18H3560.6°178.4°
NC19H36H37119.5°120.0°
C18N1C12C11124.5°123.8°
C18N1C12C1779.3°56.2°
C18N1C11C1060.4°59.4°
C18N1C11H8179.5°60.6°
C18N1C11H959.6°179.3°
C18N1C12H18165.4°63.8°
N1C18H34H35119.9°120.1°
N1C18C19H36179.6°61.6°
N1C18C19H3760.7°178.4°
N1C12C17H18115.6°120.0°
C12N1C11C10172.3°176.8°
N1C12C17C16171.0°180.0°
C12N1C11H852.3°63.2°
C12N1C11H967.6°56.9°
N1C12C13H1969.0°60.1°
N1C12C13H2050.7°60.0°
N1C12C17H3268.9°60.0°
N1C12C17H3350.8°60.0°
C12N1C18H3452.8°63.2°
C12N1C18H3567.1°56.8°
C11N1C12C1745.3°180.0°
N1C11C10N59.5°58.4°
N1C11C10H8120.1°120.0°
N1C11C10H9120.0°119.9°
N1C11H8H9119.8°120.0°
N1C11C10H16179.7°61.6°
N1C11C10H1760.7°178.4°
C11N1C12H1870.0°60.0°
C11N1C18H34179.6°60.6°
C11N1C18H3559.7°179.3°
NC9C8H14120.5°120.0°
NC9C8H15120.6°120.1°
C9NC10C11179.9°176.8°
NC9C8C7167.6°180.0°
NC9C8H1246.8°60.0°
NC9C8H1371.6°59.9°
NC9H14H15118.3°120.0°
C9NC10H1659.9°63.1°
C9NC10H1759.7°56.9°
C9NC19H3660.5°63.2°
C9NC19H3759.2°56.9°
C8C9NC1079.5°170.0°
C9C8C7H12120.8°120.0°
C9C8C7H13120.8°120.0°
C9C8C7C6168.9°174.9°
C9C8C7H1048.2°54.9°
C9C8C7H1170.3°65.1°
C9C8H12H13117.5°119.9°
C8C9H14H15118.3°119.9°
C12C17C16C1556.8°60.0°
C12C17C16H32120.1°120.0°
C12C17C16H33120.1°120.0°
C17C12C13H1962.8°59.9°
C17C12C13H20177.5°180.0°
C12C17C16H3063.4°60.0°
C12C17C16H31177.1°180.0°
C12C17H32H33119.6°120.0°
NC10C11H16120.2°120.0°
NC10C11H17120.2°120.0°
NC10C11H8179.6°61.5°
NC10C11H960.5°178.4°
C10NC9H14159.9°50.0°
C10NC9H1541.0°70.0°
NC10H16H17119.4°120.1°
C10NC19H36177.4°60.7°
C10NC19H3763.0°179.3°
C10C11H8H9119.9°120.1°
C11C10H16H17119.4°120.0°
C21C22C23H39180.0°180.0°
C22C21C20H38180.0°180.0°
C21C22C23C10.3°0.1°
C22C21C20C6177.4°179.7°
C22C21C20C20.6°0.1°
C21C22C23H40179.7°179.8°
C23C22C21C200.0°0.0°
C22C23C1H40180.0°179.9°
C22C23C1C20.0°0.0°
C22C23C1O179.6°180.0°
C23C22C21H38179.9°180.0°
C15C16C17H30120.2°120.0°
C15C16C17H31120.3°120.0°
C16C15C14H364.3°60.0°
C16C15C14H4176.2°180.0°
C16C15H28H29119.3°120.0°
C15C16H30H31119.3°120.0°
C15C16C17H3263.3°60.0°
C15C16C17H33176.9°180.0°
C8C7C6H10120.8°120.0°
C8C7C6H11120.8°120.0°
C8C7C6C20163.7°173.8°
C8C7C6C572.1°65.1°
C8C7C6H744.8°54.3°
C8C7H10H11117.6°119.9°
C7C8H12H13117.5°120.0°
C7C8C9H1471.9°60.0°
C7C8C9H1547.0°60.0°
C7C6C20C2141.0°42.3°
C7C6C20C5122.2°120.2°
C7C6C20H7118.7°119.5°
C7C6C20C2141.0°137.9°
C7C6C5H7116.9°119.5°
C7C6C5C4172.1°171.3°
C7C6C5H567.6°51.5°
C7C6C5H651.9°68.9°
C6C7H10H11117.7°120.0°
C6C7C8H1270.3°65.1°
C6C7C8H1348.1°54.8°
C21C20C6C2177.9°179.8°
C21C20C2C10.9°0.2°
C21C20C6C5163.3°162.5°
C21C20C2C3178.1°179.6°
C21C20C6H777.6°77.2°
C20C21C22H39180.0°180.0°
C23C1C2C200.6°0.1°
C23C1C2O179.6°180.0°
C23C1OC0.6°0.0°
C23C1C2C3178.4°179.6°
C1C23C22H39179.7°179.9°
C16C17C12H1855.4°60.0°
C17C16C15H28176.4°180.0°
C17C16C15H2964.1°60.0°
C17C16H30H31119.2°120.0°
C16C17H32H33119.6°120.0°
C6C20C2C1177.1°179.7°
C20C6C5H7119.2°120.3°
C6C20C2C33.9°0.6°
C20C6C5C448.2°51.1°
C20C6C5H5168.5°68.7°
C20C6C5H672.0°170.8°
C20C6C7H1075.5°53.8°
C20C6C7H1142.9°66.2°
C6C20C21H382.6°0.2°
C20C2C1C3179.0°179.8°
C20C2C1O179.0°179.9°
C2C20C6C518.8°17.7°
C20C2C3C418.3°17.7°
C2C20C6H7100.3°102.6°
C20C2C3H22102.3°138.0°
C20C2C3H23138.8°102.6°
C2C20C21H38179.5°179.9°
C2C1OC179.0°180.0°
C1C2C3C4162.7°162.5°
C1C2C3H2276.7°42.3°
C1C2C3H2342.1°77.1°
C2C1C23H40180.0°179.9°
OC1C2C31.9°0.3°
C1OCH25180.0°60.0°
C1OCH2660.0°60.0°
C1OCH2760.0°180.0°
OC1C23H400.4°0.1°
OCH25H26120.0°120.0°
OCH25H27120.0°120.0°
OCH26H27120.0°120.0°
C6C5C4H5120.3°119.7°
C6C5C4H6120.2°119.8°
C6C5C4C363.6°69.9°
C6C5C4H156.5°49.8°
C6C5C4H2176.4°170.4°
C6C5H5H6119.2°120.5°
C5C6C7H1048.6°174.9°
C5C6C7H11167.1°54.8°
C2C3C4C547.0°51.1°
C2C3C4H22120.6°120.3°
C2C3C4H23120.5°120.3°
C2C3C4H173.1°68.7°
C2C3C4H2167.0°170.9°
C2C3H22H23118.3°119.5°
C5C4C3H1120.1°119.8°
C5C4C3H2120.1°119.7°
C5C4H1H2119.7°120.6°
C4C5H5H6119.2°120.5°
C4C5C6H771.0°69.2°
C5C4C3H2273.6°171.4°
C5C4C3H23167.5°69.2°
C3C4H1H2119.8°120.5°
C3C4C5H5176.2°49.8°
C3C4C5H656.7°170.3°
C4C3H22H23118.3°119.5°
H1C4C5H563.7°169.6°
H1C4C5H6176.8°69.9°
H1C4C3H22166.3°51.6°
H1C4C3H2347.4°171.0°
H2C4C5H556.1°69.9°
H2C4C5H663.4°50.6°
H2C4C3H2246.5°68.9°
H2C4C3H2372.4°50.6°
H3C14C13H19176.1°180.0°
H3C14C13H2056.4°60.0°
H3C14C15H2855.9°60.0°
H3C14C15H29175.4°180.0°
H4C14C13H1956.5°60.1°
H4C14C13H2063.2°60.0°
H4C14C15H2863.6°59.9°
H4C14C15H2955.9°60.0°
H5C5C6H749.3°171.0°
H6C5C6H7168.8°50.5°
H7C6C7H10165.6°65.7°
H7C6C7H1175.9°174.3°
H8C11C10H1660.2°178.4°
H8C11C10H1759.4°58.4°
H9C11C10H1659.7°58.4°
H9C11C10H17179.3°61.6°
H10C7C8H12168.9°174.9°
H10C7C8H1372.6°65.2°
H11C7C8H1250.5°54.9°
H11C7C8H13168.9°174.9°
H12C8C9H14167.3°180.0°
H12C8C9H1573.7°60.1°
H13C8C9H1448.9°60.1°
H13C8C9H15167.8°180.0°
H18C12C13H19175.7°179.9°
H18C12C13H2064.6°60.0°
H18C12C17H32175.5°180.0°
H18C12C17H3364.7°60.0°
H25CH26H27120.0°119.9°
H28C15C16H3056.1°60.0°
H28C15C16H3163.4°60.0°
H29C15C16H30175.6°180.0°
H29C15C16H3156.2°60.0°
H30C16C17H32176.5°180.0°
H30C16C17H3356.7°60.0°
H31C16C17H3257.0°60.0°
H31C16C17H3362.8°60.0°
H34C18C19H3660.3°178.5°
H34C18C19H3759.3°58.4°
H35C18C19H3659.6°58.4°
H35C18C19H37179.2°61.7°
H38C21C22H390.1°0.0°
H39C22C23H400.3°0.2°

224931

PDB entries from 2024-09-11

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