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Q4T

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O24C23doub1.21Å1.22Å
C23O25sing1.34Å1.32Å
C23C22sing1.51Å1.50Å
F33C19sing1.35Å1.32Å
C18C19doub1.38Å1.39ÅAromatic
C18C17sing1.38Å1.40ÅAromatic
C22C17sing1.51Å1.54Å
C19C20sing1.39Å1.40ÅAromatic
CL1C3sing1.74Å1.74Å
C17C16doub1.39Å1.42ÅAromatic
C2C3doub1.38Å1.38ÅAromatic
C2C1sing1.38Å1.39ÅAromatic
N29C30sing1.47Å1.48Å
N29C28sing1.47Å1.48Å
C3C4sing1.39Å1.38ÅAromatic
C20C21doub1.38Å1.40ÅAromatic
C30C31sing1.53Å1.55Å
C16C21sing1.39Å1.40ÅAromatic
C16N14sing1.40Å1.42Å
F36C1sing1.35Å1.34Å
C1C6doub1.40Å1.40ÅAromatic
F34C10sing1.35Å1.34Å
C31C32sing1.53Å1.55Å
C4O26sing1.36Å1.40Å
C4C5doub1.38Å1.40ÅAromatic
N14C13sing1.35Å1.36Å
O26C27sing1.43Å1.45Å
C28C27sing1.53Å1.56Å
C6C5sing1.39Å1.39ÅAromatic
C6C9sing1.48Å1.48Å
C27C32sing1.53Å1.55Å
C10C9doub1.39Å1.40ÅAromatic
C10C11sing1.40Å1.42ÅAromatic
C13C11sing1.48Å1.53Å
C13O15doub1.22Å1.22Å
C9C8sing1.39Å1.40ÅAromatic
C11C12doub1.40Å1.40ÅAromatic
C8C7doub1.38Å1.39ÅAromatic
C12C7sing1.38Å1.40ÅAromatic
C2H1sing1.08Å1.08Å
C12H2sing1.08Å1.08Å
C18H3sing1.08Å1.08Å
C20H4sing1.08Å1.08Å
C21H5sing1.08Å1.08Å
C22H6sing1.09Å1.10Å
C22H7sing1.09Å1.10Å
C27H8sing1.09Å1.10Å
C28H9sing1.09Å1.10Å
C28H10sing1.09Å1.10Å
C30H11sing1.09Å1.10Å
C30H12sing1.09Å1.10Å
C5H13sing1.08Å1.08Å
C7H14sing1.08Å1.08Å
C8H15sing1.08Å1.08Å
N14H16sing0.97Å1.00Å
O25H17sing0.97Å0.95Å
N29H18sing1.01Å1.00Å
C31H20sing1.09Å1.10Å
C31H21sing1.09Å1.10Å
C32H22sing1.09Å1.10Å
C32H23sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O24C23O25122.2°120.0°
O24C23C22124.9°120.0°
O25C23C22112.7°120.0°
C23O25H17109.5°117.0°
C23C22C17106.3°109.5°
C23C22H6110.3°109.4°
C23C22H7110.3°109.5°
F33C19C18119.0°119.9°
F33C19C20120.0°120.0°
C19C18C17120.1°120.0°
C18C19C20121.0°120.1°
C19C18H3119.9°120.0°
C18C17C22117.9°120.0°
C18C17C16119.7°120.0°
C17C18H3120.0°120.0°
C22C17C16122.3°120.0°
C17C22H6110.3°109.5°
C17C22H7110.3°109.5°
C19C20C21119.4°120.1°
C19C20H4120.3°120.0°
CL1C3C2120.2°119.8°
CL1C3C4119.0°119.9°
C17C16C21119.4°119.9°
C17C16N14119.8°120.1°
C3C2C1120.3°120.1°
C2C3C4120.8°120.2°
C3C2H1119.9°120.0°
C2C1F36118.4°120.0°
C2C1C6119.7°120.0°
C1C2H1119.8°119.9°
C30N29C28110.9°111.2°
N29C30C31110.9°109.6°
N29C30H11109.1°109.5°
N29C30H12109.1°109.4°
C30N29H18109.1°111.0°
N29C28C27109.9°109.5°
N29C28H9109.4°109.5°
N29C28H10109.4°109.5°
C28N29H18109.1°111.0°
C3C4O26117.5°120.0°
C3C4C5118.9°120.0°
C20C21C16120.5°119.9°
C21C20H4120.3°120.0°
C20C21H5119.8°120.1°
C30C31C32109.7°109.3°
C31C30H11109.1°109.5°
C31C30H12109.1°109.4°
C30C31H20109.4°109.5°
C30C31H21109.4°109.5°
C21C16N14120.6°120.0°
C16C21H5119.8°120.0°
C16N14C13128.7°120.1°
C16N14H16115.6°120.0°
F36C1C6121.8°120.0°
C1C6C5119.4°119.8°
C1C6C9120.0°120.1°
F34C10C9116.1°120.2°
F34C10C11123.1°120.2°
C31C32C27108.1°109.1°
C32C31H20109.4°109.5°
C32C31H21109.4°109.5°
C31C32H22109.8°109.5°
C31C32H23109.8°109.5°
O26C4C5123.5°120.0°
C4O26C27121.9°117.0°
C4C5C6120.8°119.9°
C4C5H13119.6°120.0°
N14C13C11120.1°120.0°
N14C13O15122.5°120.0°
C13N14H16115.6°120.0°
O26C27C28110.5°109.6°
O26C27C32107.3°109.4°
O26C27H8111.0°109.5°
C28C27C32109.1°109.2°
C28C27H8109.4°109.6°
C27C28H9109.4°109.4°
C27C28H10109.4°109.5°
C5C6C9120.4°120.1°
C6C5H13119.6°120.1°
C6C9C10119.6°120.0°
C6C9C8120.1°120.1°
C32C27H8109.5°109.5°
C27C32H22109.8°109.6°
C27C32H23109.8°109.5°
C9C10C11120.7°119.6°
C10C9C8120.2°119.9°
C10C11C13122.4°120.1°
C10C11C12117.1°119.8°
C11C13O15117.4°120.0°
C13C11C12120.4°120.1°
C9C8C7119.8°120.3°
C9C8H15120.1°119.9°
C11C12C7122.6°120.1°
C11C12H2118.7°120.0°
C8C7C12119.4°120.3°
C8C7H14120.3°119.9°
C7C8H15120.1°119.8°
C7C12H2118.7°119.9°
C12C7H14120.3°119.8°
H6C22H7109.4°109.4°
H9C28H10109.4°109.5°
H11C30H12109.4°109.5°
H20C31H21109.4°109.5°
H22C32H23109.4°109.6°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O24C23O25C22175.0°180.0°
O24C23C22C1797.7°0.0°
O24C23C22H6142.8°120.0°
O24C23C22H721.9°120.0°
O24C23O25H170.0°0.1°
O25C23C22C1777.1°180.0°
O25C23C22H642.4°60.0°
O25C23C22H7163.3°59.9°
C23C22C17C1889.1°95.0°
C23C22C17H6119.5°120.0°
C23C22C17H7119.5°120.0°
C23C22C17C1687.3°85.0°
C23C22H6H7121.4°120.0°
C22C23O25H17175.0°179.9°
F33C19C18C20178.0°180.0°
F33C19C18C17177.3°179.9°
F33C19C20C21178.9°180.0°
F33C19C18H32.7°0.1°
F33C19C20H41.1°0.1°
C19C18C17H3180.0°179.9°
C19C18C17C22178.1°179.9°
C19C18C17C161.6°0.1°
C18C19C20C210.9°0.1°
C18C19C20H4179.0°180.0°
C18C17C22C16176.4°180.0°
C17C18C19C200.6°0.1°
C18C17C16C211.0°0.1°
C18C17C16N14174.3°179.7°
C18C17C22H6151.4°25.0°
C18C17C22H730.4°145.0°
C22C17C16C21177.3°180.0°
C22C17C16N142.0°0.3°
C22C17C18H31.9°0.0°
C17C22H6H7121.5°120.0°
C19C20C21H4180.0°179.9°
C19C20C21C161.5°0.0°
C20C19C18H3179.4°180.0°
C19C20C21H5178.4°179.8°
CL1C3C2C4179.2°180.0°
CL1C3C2C1178.6°180.0°
CL1C3C4O261.0°0.0°
CL1C3C4C5177.6°180.0°
CL1C3C2H11.4°0.0°
C17C16C21C200.6°0.0°
C17C16C21N14175.3°179.8°
C17C16N14C13132.5°155.5°
C16C17C18H3178.4°180.0°
C17C16C21H5179.4°179.8°
C16C17C22H632.2°155.0°
C16C17C22H7153.2°35.0°
C17C16N14H1647.5°24.5°
C3C2C1H1180.0°179.9°
C3C2C1F36178.2°179.8°
C3C2C1C61.4°0.0°
C2C3C4O26178.2°180.0°
C2C3C4C51.6°0.0°
C1C2C3C40.5°0.1°
C2C1F36C6176.7°179.7°
C2C1C6C53.4°0.0°
C2C1C6C9178.9°179.9°
C30N29C28H18120.2°124.1°
N29C30C31H11120.2°120.0°
N29C30C31H12120.2°120.0°
N29C30C31C3258.3°59.2°
C30N29C28C2760.7°61.7°
C30N29C28H9179.2°178.3°
C30N29C28H1059.4°58.3°
N29C30H11H12119.3°119.9°
N29C30C31H20178.3°60.8°
N29C30C31H2161.8°179.2°
C28N29C30C3159.6°61.7°
N29C28C27O2657.2°179.1°
N29C28C27H9120.1°120.0°
N29C28C27H10120.1°120.0°
N29C28C27C3260.5°59.2°
N29C28C27H8179.7°60.8°
N29C28H9H10119.8°120.0°
C28N29C30H1160.6°178.2°
C28N29C30H12179.9°58.3°
C3C4O26C5176.4°180.0°
C3C4O26C27166.0°174.5°
C3C4C5C63.6°0.1°
C4C3C2H1179.5°180.0°
C3C4C5H13176.4°180.0°
C20C21C16H5180.0°179.7°
C20C21C16N14175.8°179.7°
C30C31C32H20120.1°119.9°
C30C31C32H21120.1°120.0°
C30C31C32C2757.6°57.7°
C31C30H11H12119.4°119.9°
C31C30N29H1860.6°174.2°
C30C31H20H21119.9°120.1°
C30C31C32H2262.2°62.3°
C30C31C32H23177.4°177.5°
C21C16N14C1352.2°24.8°
C16C21C20H4178.4°179.9°
C21C16N14H16127.8°155.3°
C16N14C13H16180.0°179.9°
C16N14C13C11179.0°174.2°
C16N14C13O150.3°5.8°
N14C16C21H54.1°0.0°
F36C1C6C5180.0°179.7°
F36C1C6C94.4°0.2°
F36C1C2H11.8°0.3°
C1C6C5C44.5°0.1°
C1C6C5C9175.5°179.9°
C1C6C9C1065.5°64.8°
C1C6C9C8111.8°115.0°
C6C1C2H1178.6°180.0°
C1C6C5H13175.5°180.0°
F34C10C9C63.0°0.0°
F34C10C9C11179.2°179.7°
F34C10C11C131.2°0.1°
F34C10C9C8179.7°179.8°
F34C10C11C12178.2°179.8°
C31C32C27O2660.9°177.6°
C31C32C27C2858.8°57.7°
C31C32C27H22119.8°119.9°
C31C32C27H23119.8°119.8°
C31C32C27H8178.5°62.3°
C32C31C30H1162.0°179.2°
C32C31C30H12178.5°60.8°
C32C31H20H21119.9°120.1°
C31C32H22H23120.6°120.1°
C4O26C27C2875.7°94.6°
O26C4C5C6180.0°180.0°
C4O26C27C32165.4°145.7°
C4O26C27H845.8°25.6°
O26C4C5H130.0°0.1°
C5C4O26C2717.5°5.5°
C4C5C6H13180.0°179.9°
C4C5C6C9180.0°180.0°
N14C13C11C1011.1°179.7°
N14C13C11O15178.8°180.0°
N14C13C11C12172.0°0.1°
O26C27C28C32117.8°119.9°
O26C27C28H8122.5°120.1°
O26C27C32H8120.6°120.0°
O26C27C28H962.9°60.9°
O26C27C28H10177.3°59.1°
O26C27C32H22179.3°57.7°
O26C27C32H2358.9°62.5°
C28C27C32H8119.7°120.0°
C27C28H9H10119.8°120.0°
C27C28N29H1859.5°174.2°
C28C27C32H2261.0°62.2°
C28C27C32H23178.6°177.5°
C5C6C9C10119.0°115.3°
C5C6C9C863.7°64.9°
C6C9C10C8177.3°179.7°
C6C9C10C11176.2°179.7°
C6C9C8C7179.2°180.0°
C9C6C5H130.0°0.1°
C6C9C8H150.8°0.0°
C32C27C28H9179.4°179.3°
C32C27C28H1059.5°60.8°
C27C32C31H20177.7°62.3°
C27C32C31H2162.4°177.7°
C27C32H22H23120.7°120.2°
C9C10C11C13179.7°179.8°
C9C10C11C122.7°0.5°
C10C9C8C71.9°0.3°
C10C9C8H15178.1°179.7°
C10C11C13C12176.9°179.7°
C10C11C13O15167.7°0.3°
C11C10C9C81.1°0.6°
C10C11C12C71.4°0.2°
C10C11C12H2178.7°179.7°
C13C11C12C7178.4°179.9°
C13C11C12H21.6°0.1°
C11C13N14H161.0°5.8°
O15C13C11C129.2°180.0°
O15C13N14H16179.7°174.2°
C9C8C7H15180.0°180.0°
C9C8C7C123.2°0.1°
C9C8C7H14176.7°180.0°
C11C12C7C81.6°0.1°
C11C12C7H2180.0°179.9°
C11C12C7H14178.4°180.0°
C8C7C12H14180.0°179.9°
C8C7C12H2178.4°180.0°
C12C7C8H15176.8°180.0°
H2C12C7H141.6°0.1°
H4C20C21H51.6°0.3°
H8C27C28H959.6°59.3°
H8C27C28H1060.3°179.2°
H8C27C32H2258.7°177.8°
H8C27C32H2361.7°57.5°
H9C28N29H1860.6°54.2°
H10C28N29H18179.6°65.8°
H11C30N29H18179.2°54.2°
H11C30C31H2058.1°59.3°
H11C30C31H21178.0°60.8°
H12C30N29H1859.7°65.8°
H12C30C31H2061.4°179.2°
H12C30C31H2158.5°59.2°
H14C7C8H153.3°0.0°
H20C31C32H2257.9°177.8°
H20C31C32H2362.5°57.6°
H21C31C32H22177.8°57.7°
H21C31C32H2357.4°62.5°

223790

PDB entries from 2024-08-14

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