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Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C14C13sing1.53Å1.53Å
C21C22sing1.53Å1.50Å
C21C20sing1.53Å1.51Å
C22C23sing1.53Å1.50Å
C19C20sing1.53Å1.50Å
C19C18sing1.53Å1.50Å
C17C18sing1.53Å1.51Å
C17S16sing1.81Å1.81Å
C13S16sing1.81Å1.82Å
C13C15sing1.53Å1.53Å
C13C12sing1.53Å1.55Å
C23C24sing1.53Å1.52Å
C24C25sing1.53Å1.51Å
C11C12sing1.51Å1.51Å
C11O29doub1.21Å1.23Å
C26C25sing1.53Å1.52Å
C26C27sing1.53Å1.50Å
C27C28sing1.53Å1.51Å
C12H2sing1.09Å1.10Å
C12H3sing1.09Å1.10Å
C21H4sing1.09Å1.10Å
C21H5sing1.09Å1.10Å
C14H6sing1.09Å1.10Å
C14H7sing1.09Å1.10Å
C14H8sing1.09Å1.10Å
C17H9sing1.09Å1.10Å
C17H10sing1.09Å1.10Å
C18H11sing1.09Å1.10Å
C18H12sing1.09Å1.10Å
C19H13sing1.09Å1.10Å
C19H14sing1.09Å1.10Å
C20H15sing1.09Å1.10Å
C20H16sing1.09Å1.10Å
C15H17sing1.09Å1.10Å
C15H18sing1.09Å1.10Å
C15H19sing1.09Å1.10Å
C22H20sing1.09Å1.10Å
C22H21sing1.09Å1.10Å
C23H22sing1.09Å1.10Å
C23H23sing1.09Å1.10Å
C24H24sing1.09Å1.10Å
C24H25sing1.09Å1.10Å
C25H26sing1.09Å1.10Å
C25H27sing1.09Å1.10Å
C26H28sing1.09Å1.10Å
C26H29sing1.09Å1.10Å
C27H30sing1.09Å1.10Å
C27H31sing1.09Å1.10Å
C28H32sing1.09Å1.10Å
C28H33sing1.09Å1.10Å
C28H34sing1.09Å1.10Å
C11O1sing1.34Å1.33Å
O1H1sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C14C13S16113.5°109.5°
C14C13C15110.6°109.4°
C14C13C12109.9°109.4°
C13C14H6109.5°109.4°
C13C14H7109.4°109.5°
C13C14H8109.5°109.4°
C22C21C20111.4°109.5°
C21C22C23111.8°109.5°
C22C21H4109.0°109.5°
C22C21H5109.0°109.5°
C21C22H20108.9°109.4°
C21C22H21108.9°109.5°
C21C20C19112.5°109.5°
C20C21H4109.0°109.5°
C20C21H5109.0°109.4°
C21C20H15108.7°109.4°
C21C20H16108.7°109.4°
C22C23C24113.6°109.5°
C23C22H20108.9°109.4°
C23C22H21108.9°109.5°
C22C23H22108.4°109.4°
C22C23H23108.4°109.5°
C20C19C18112.8°109.5°
C20C19H13108.6°109.5°
C20C19H14108.6°109.5°
C19C20H15108.7°109.5°
C19C20H16108.7°109.4°
C19C18C17111.1°109.5°
C19C18H11109.1°109.5°
C19C18H12109.1°109.5°
C18C19H13108.6°109.5°
C18C19H14108.6°109.5°
C18C17S16105.2°109.5°
C18C17H9110.5°109.5°
C18C17H10110.5°109.4°
C17C18H11109.0°109.4°
C17C18H12109.0°109.5°
C17S16C13102.1°103.0°
S16C17H9110.5°109.4°
S16C17H10110.5°109.4°
S16C13C15109.4°109.5°
S16C13C12102.0°109.5°
C15C13C12111.0°109.5°
C13C15H17109.5°109.5°
C13C15H18109.5°109.5°
C13C15H19109.5°109.5°
C13C12C11114.4°109.4°
C13C12H2108.2°109.5°
C13C12H3108.2°109.5°
C23C24C25112.8°109.5°
C24C23H22108.4°109.5°
C24C23H23108.4°109.5°
C23C24H24108.6°109.5°
C23C24H25108.6°109.5°
C24C25C26113.1°109.5°
C25C24H24108.6°109.5°
C25C24H25108.6°109.4°
C24C25H26108.6°109.4°
C24C25H27108.6°109.5°
C12C11O29121.9°120.0°
C11C12H2108.3°109.5°
C11C12H3108.2°109.4°
C12C11O1115.1°119.9°
O29C11O1123.0°120.1°
C25C26C27111.5°109.5°
C26C25H26108.6°109.4°
C26C25H27108.6°109.5°
C25C26H28109.0°109.5°
C25C26H29109.0°109.5°
C26C27C28111.0°109.5°
C27C26H28108.9°109.5°
C27C26H29108.9°109.5°
C26C27H30109.1°109.5°
C26C27H31109.1°109.4°
C28C27H30109.1°109.5°
C28C27H31109.1°109.5°
C27C28H32109.5°109.5°
C27C28H33109.5°109.5°
C27C28H34109.4°109.5°
H2C12H3109.5°109.5°
H4C21H5109.5°109.4°
H6C14H7109.4°109.5°
H6C14H8109.5°109.4°
H7C14H8109.5°109.5°
H9C17H10109.4°109.5°
H11C18H12109.5°109.4°
H13C19H14109.5°109.4°
H15C20H16109.5°109.5°
H17C15H18109.5°109.5°
H17C15H19109.5°109.5°
H18C15H19109.5°109.4°
H20C22H21109.5°109.5°
H22C23H23109.5°109.5°
H24C24H25109.5°109.4°
H26C25H27109.4°109.5°
H28C26H29109.5°109.4°
H30C27H31109.5°109.4°
H32C28H33109.5°109.5°
H32C28H34109.5°109.4°
H33C28H34109.5°109.5°
C11O1H1109.5°117.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C14C13S16C1761.7°60.0°
C14C13S16C15124.1°120.0°
C14C13S16C12118.2°120.0°
C14C13C15C12122.3°119.9°
C14C13C12C1166.2°178.4°
C14C13C12H254.5°61.6°
C14C13C12H3173.1°58.5°
C13C14H6H7120.0°120.0°
C13C14H6H8120.0°119.9°
C13C14H7H8120.0°120.0°
C14C13C15H17180.0°53.4°
C14C13C15H1860.0°66.6°
C14C13C15H1960.0°173.4°
C22C21C20H4120.3°120.0°
C22C21C20H5120.3°120.0°
C21C22C23H20120.4°120.0°
C21C22C23H21120.4°120.0°
C22C21C20C19177.3°NaN°
C21C22C23C24144.3°180.0°
C22C21H4H5119.1°120.0°
C22C21C20H1556.9°60.0°
C22C21C20H1662.2°60.0°
C21C22H20H21119.0°120.0°
C21C22C23H2295.1°60.0°
C21C22C23H2323.7°59.9°
C20C21C22C2351.8°180.0°
C21C20C19H15120.4°120.0°
C21C20C19H16120.4°120.0°
C21C20C19C18176.4°180.0°
C20C21H4H5119.1°119.9°
C21C20C19H1355.9°60.0°
C21C20C19H1463.1°60.0°
C21C20H15H16118.6°120.0°
C20C21C22H2068.5°60.0°
C20C21C22H21172.2°60.0°
C22C23C24H22120.6°119.9°
C22C23C24H23120.6°120.0°
C22C23C24C25156.6°180.0°
C23C22C21H468.4°60.0°
C23C22C21H5172.1°60.0°
C23C22H20H21118.9°120.0°
C22C23H22H23118.1°120.0°
C22C23C24H2436.1°60.0°
C22C23C24H2582.9°60.0°
C20C19C18H13120.5°120.0°
C20C19C18H14120.5°120.0°
C20C19C18C17176.3°NaN°
C19C20C21H462.4°60.0°
C19C20C21H557.0°60.0°
C20C19C18H1156.0°60.0°
C20C19C18H1263.5°60.0°
C20C19H13H14118.5°120.0°
C19C20H15H16118.6°120.0°
C19C18C17H11120.2°120.1°
C19C18C17H12120.3°120.0°
C19C18C17S16178.8°180.0°
C19C18C17H961.9°60.0°
C19C18C17H1059.4°60.0°
C19C18H11H12119.3°120.0°
C18C19H13H14118.5°120.0°
C18C19C20H1563.1°60.0°
C18C19C20H1656.0°60.0°
C18C17S16H9119.3°120.0°
C18C17S16H10119.4°120.0°
C18C17S16C13176.2°180.0°
C18C17H9H10122.0°120.0°
C17C18H11H12119.2°119.9°
C17C18C19H1363.2°60.0°
C17C18C19H1455.8°60.0°
C17S16C13C1562.4°60.0°
C17S16C13C12179.9°180.0°
S16C17H9H10122.0°120.0°
S16C17C18H1158.6°59.9°
S16C17C18H1261.0°60.0°
S16C13C15C12111.9°120.0°
S16C13C12C11173.0°61.6°
S16C13C12H266.3°58.5°
S16C13C12H352.3°178.5°
S16C13C14H6180.0°60.0°
S16C13C14H760.0°180.0°
S16C13C14H860.0°59.9°
C13S16C17H964.5°60.0°
C13S16C17H1056.8°60.0°
S16C13C15H1754.2°66.6°
S16C13C15H1865.8°173.3°
S16C13C15H19174.2°53.4°
C15C13C12C1156.5°58.5°
C15C13C12H2177.2°178.5°
C15C13C12H364.2°61.5°
C15C13C14H656.5°180.0°
C15C13C14H763.5°60.0°
C15C13C14H8176.5°60.1°
C13C15H17H18120.0°120.0°
C13C15H17H19120.0°120.0°
C13C15H18H19120.0°120.0°
C13C12C11H2120.7°120.0°
C13C12C11H3120.7°119.9°
C13C12C11O2986.6°6.8°
C13C12H2H3117.8°120.0°
C12C13C14H666.4°60.1°
C12C13C14H7173.6°60.0°
C12C13C14H853.6°180.0°
C12C13C15H1757.7°173.3°
C12C13C15H18177.7°53.3°
C12C13C15H1962.3°66.7°
C13C12C11O194.3°173.0°
C23C24C25H24120.5°120.0°
C23C24C25H25120.5°120.0°
C23C24C25C26154.8°180.0°
C24C23C22H2023.9°60.0°
C24C23C22H2195.3°60.0°
C24C23H22H23118.1°120.1°
C23C24H24H25118.5°120.0°
C23C24C25H2684.6°60.0°
C23C24C25H2734.3°60.0°
C24C25C26H26120.5°120.0°
C24C25C26H27120.5°120.0°
C24C25C26C27177.5°180.0°
C25C24C23H2282.8°60.1°
C25C24C23H2336.0°60.0°
C25C24H24H25118.5°119.9°
C24C25H26H27118.3°120.0°
C24C25C26H2857.2°60.0°
C24C25C26H2962.2°60.0°
C12C11O29O1179.1°179.8°
C11C12H2H3117.8°120.0°
C12C11O1H1179.1°180.0°
O29C11C12H2152.6°113.2°
O29C11C12H334.1°126.7°
O29C11O1H10.0°0.2°
C25C26C27H28120.3°120.0°
C25C26C27H29120.3°120.0°
C25C26C27C2843.3°180.0°
C26C25C24H2434.3°60.0°
C26C25C24H2584.7°60.0°
C26C25H26H27118.4°120.0°
C25C26H28H29119.1°120.0°
C25C26C27H30163.5°60.0°
C25C26C27H3176.9°60.0°
C26C27C28H30120.2°120.0°
C26C27C28H31120.2°120.0°
C27C26C25H2662.0°60.0°
C27C26C25H2756.9°60.0°
C27C26H28H29119.0°120.0°
C26C27H30H31119.3°119.9°
C26C27C28H32180.0°60.0°
C26C27C28H3360.0°60.0°
C26C27C28H3460.0°180.0°
C28C27C26H2877.0°60.0°
C28C27C26H29163.6°60.0°
C28C27H30H31119.3°120.0°
C27C28H32H33120.0°120.1°
C27C28H32H34120.0°120.0°
C27C28H33H34120.0°120.1°
H2C12C11O126.5°67.0°
H3C12C11O1145.0°53.0°
H4C21C20H15177.2°60.1°
H4C21C20H1658.1°180.0°
H4C21C22H20171.2°180.0°
H4C21C22H2151.9°60.1°
H5C21C20H1563.4°180.0°
H5C21C20H16177.5°60.0°
H5C21C22H2051.8°60.0°
H5C21C22H2167.5°180.0°
H6C14H7H8120.0°120.0°
H9C17C18H11177.9°60.1°
H9C17C18H1258.4°180.0°
H10C17C18H1160.8°179.9°
H10C17C18H12179.7°60.0°
H11C18C19H13176.5°180.0°
H11C18C19H1464.4°60.0°
H12C18C19H1357.0°60.0°
H12C18C19H14176.0°NaN°
H13C19C20H15176.4°60.0°
H13C19C20H1664.5°180.0°
H14C19C20H1557.4°180.0°
H14C19C20H16176.5°60.0°
H17C15H18H19120.0°120.0°
H20C22C23H22144.5°180.0°
H20C22C23H2396.7°60.0°
H21C22C23H2225.3°60.0°
H21C22C23H23144.1°180.0°
H22C23C24H24156.7°179.9°
H22C23C24H2537.7°59.9°
H23C23C24H2484.5°60.0°
H23C23C24H25156.5°180.0°
H24C24C25H26154.9°180.0°
H24C24C25H2786.2°60.0°
H25C24C25H2635.9°60.0°
H25C24C25H27154.8°180.0°
H26C25C26H28177.7°180.0°
H26C25C26H2958.3°60.0°
H27C25C26H2863.4°60.1°
H27C25C26H29177.2°180.0°
H28C26C27H3043.2°180.0°
H28C26C27H31162.7°60.1°
H29C26C27H3076.1°60.0°
H29C26C27H3143.4°180.0°
H30C27C28H3259.8°180.0°
H30C27C28H33179.8°60.0°
H30C27C28H3460.2°60.0°
H31C27C28H3259.8°60.0°
H31C27C28H3360.2°180.0°
H31C27C28H34179.8°60.0°
H32C28H33H34120.0°119.9°

248942

PDB entries from 2026-02-11

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