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XL9

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C24C23sing1.53Å1.50Å
C23C22sing1.51Å1.50Å
O4C22doub1.21Å1.23Å
C22N4sing1.35Å1.34Å
CL2C4sing1.74Å1.73Å
C8O2sing1.43Å1.42Å
N4C18sing1.47Å1.46Å
O2C5sing1.36Å1.37Å
C5C4doub1.39Å1.39ÅAromatic
C5C6sing1.39Å1.39ÅAromatic
C4C3sing1.39Å1.40ÅAromatic
C15N1doub1.32Å1.33ÅAromatic
C15C11sing1.41Å1.41ÅAromatic
C18C17sing1.53Å1.53Å
C18C19sing1.53Å1.53Å
N1C16sing1.33Å1.35ÅAromatic
C10C11doub1.40Å1.40ÅAromatic
C10C9sing1.38Å1.37ÅAromatic
C11C12sing1.42Å1.42ÅAromatic
C16N3sing1.38Å1.45Å
C16N2doub1.32Å1.35ÅAromatic
N3C17sing1.47Å1.46Å
C17C21sing1.53Å1.52Å
C6C1doub1.39Å1.39ÅAromatic
C3C9sing1.48Å1.49Å
C3C2doub1.39Å1.40ÅAromatic
C9C14doub1.40Å1.43ÅAromatic
C12N2sing1.34Å1.37ÅAromatic
C12C13doub1.40Å1.41ÅAromatic
C13C14sing1.36Å1.37ÅAromatic
C19C20sing1.53Å1.51Å
C1C2sing1.39Å1.39ÅAromatic
C1O1sing1.36Å1.36Å
C2CL1sing1.74Å1.75Å
C21O3sing1.43Å1.43Å
C7O1sing1.43Å1.43Å
C20O3sing1.43Å1.42Å
C6H1sing1.08Å1.08Å
C7H2sing1.09Å1.10Å
C7H3sing1.09Å1.10Å
C7H4sing1.09Å1.10Å
C8H5sing1.09Å1.10Å
C8H6sing1.09Å1.10Å
C8H7sing1.09Å1.10Å
C10H8sing1.08Å1.08Å
C13H9sing1.08Å1.08Å
C14H10sing1.08Å1.08Å
C15H11sing1.08Å1.08Å
N3H12sing0.97Å1.00Å
C17H13sing1.09Å1.10Å
C18H14sing1.09Å1.10Å
C19H15sing1.09Å1.10Å
C19H16sing1.09Å1.10Å
C20H17sing1.09Å1.10Å
C20H18sing1.09Å1.10Å
C21H19sing1.09Å1.10Å
C21H20sing1.09Å1.10Å
N4H21sing0.97Å1.00Å
C23H22sing1.09Å1.10Å
C23H23sing1.09Å1.10Å
C24H24sing1.09Å1.10Å
C24H25sing1.09Å1.10Å
C24H26sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C24C23C22112.7°109.5°
C24C23H22108.6°109.5°
C24C23H23108.6°109.5°
C23C24H24109.5°109.5°
C23C24H25109.5°109.5°
C23C24H26109.5°109.4°
C23C22O4122.0°120.0°
C23C22N4115.0°120.0°
C22C23H22108.6°109.5°
C22C23H23108.7°109.5°
O4C22N4123.0°120.1°
C22N4C18125.0°119.9°
C22N4H21117.5°120.1°
CL2C4C5118.2°120.0°
CL2C4C3120.2°120.1°
C8O2C5120.1°117.0°
O2C8H5109.5°109.5°
O2C8H6109.4°109.5°
O2C8H7109.5°109.5°
N4C18C17111.0°109.5°
N4C18C19109.1°109.5°
N4C18H14108.8°109.6°
C18N4H21117.5°120.0°
O2C5C4115.1°119.9°
O2C5C6125.9°120.0°
C4C5C6119.1°120.1°
C5C4C3121.6°119.9°
C5C6C1120.8°120.2°
C5C6H1119.6°119.9°
C4C3C9122.4°120.1°
C4C3C2117.9°119.8°
N1C15C11122.0°118.5°
C15N1C16117.9°121.5°
N1C15H11119.0°120.8°
C15C11C10123.4°121.9°
C15C11C12117.1°118.4°
C11C15H11119.0°120.8°
C17C18C19111.9°109.0°
C18C17N3110.2°109.5°
C18C17C21110.9°109.2°
C18C17H13107.9°109.5°
C17C18H14108.0°109.6°
C18C19C20111.7°109.2°
C19C18H14108.0°109.6°
C18C19H15108.9°109.5°
C18C19H16108.9°109.5°
N1C16N3117.2°118.7°
N1C16N2125.1°122.7°
C11C10C9121.5°119.3°
C10C11C12119.5°119.6°
C11C10H8119.2°120.3°
C10C9C3119.1°119.7°
C10C9C14118.1°120.5°
C9C10H8119.2°120.4°
C11C12N2120.3°118.6°
C11C12C13119.2°119.6°
N3C16N2117.7°118.7°
C16N3C17124.8°120.0°
C16N3H12105.5°120.0°
C16N2C12117.6°120.3°
N3C17C21111.1°109.5°
C17N3H12105.5°120.0°
N3C17H13108.8°109.5°
C17C21O3111.0°109.4°
C21C17H13108.0°109.5°
C17C21H19109.1°109.5°
C17C21H20109.1°109.5°
C6C1C2119.6°120.1°
C6C1O1124.9°120.0°
C1C6H1119.6°119.9°
C9C3C2119.6°120.1°
C3C9C14122.8°119.7°
C3C2C1121.0°119.9°
C3C2CL1119.5°120.0°
C9C14C13121.8°120.9°
C9C14H10119.1°119.5°
N2C12C13120.5°121.8°
C12C13C14119.8°119.9°
C12C13H9120.1°120.1°
C14C13H9120.1°120.0°
C13C14H10119.1°119.5°
C19C20O3111.0°109.4°
C20C19H15108.9°109.5°
C20C19H16108.9°109.6°
C19C20H17109.1°109.5°
C19C20H18109.1°109.4°
C2C1O1115.5°120.0°
C1C2CL1119.5°120.0°
C1O1C7119.6°117.0°
C21O3C20110.7°114.1°
O3C21H19109.1°109.5°
O3C21H20109.1°109.5°
O1C7H2109.5°109.5°
O1C7H3109.5°109.5°
O1C7H4109.5°109.5°
O3C20H17109.1°109.5°
O3C20H18109.1°109.5°
H2C7H3109.4°109.4°
H2C7H4109.5°109.4°
H3C7H4109.5°109.5°
H5C8H6109.5°109.4°
H5C8H7109.5°109.5°
H6C8H7109.5°109.5°
H15C19H16109.4°109.6°
H17C20H18109.4°109.5°
H19C21H20109.4°109.5°
H22C23H23109.5°109.5°
H24C24H25109.5°109.4°
H24C24H26109.5°109.4°
H25C24H26109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C24C23C22H22120.5°120.0°
C24C23C22H23120.5°120.0°
C24C23C22O4110.3°0.0°
C24C23C22N468.7°180.0°
C24C23H22H23118.5°120.0°
C23C24H24H25120.0°120.0°
C23C24H24H26120.0°119.9°
C23C24H25H26120.0°120.0°
C23C22O4N4178.9°180.0°
C23C22N4C18178.7°180.0°
C23C22N4H211.3°0.1°
C22C23H22H23118.5°120.0°
C22C23C24H24180.0°60.0°
C22C23C24H2560.0°60.0°
C22C23C24H2660.0°180.0°
O4C22N4C182.3°0.0°
O4C22N4H21177.7°179.9°
O4C22C23H2210.2°120.0°
O4C22C23H23129.3°120.0°
C22N4C18H21180.0°179.9°
C22N4C18C1799.6°155.0°
C22N4C18C19136.7°85.5°
C22N4C18H1419.1°34.8°
N4C22C23H22170.9°60.0°
N4C22C23H2351.8°60.0°
CL2C4C5O20.3°0.0°
CL2C4C5C3179.4°180.0°
CL2C4C5C6179.3°179.8°
CL2C4C3C90.7°0.0°
CL2C4C3C2179.5°180.0°
C8O2C5C4179.8°180.0°
C8O2C5C60.2°0.2°
O2C8H5H6120.0°120.0°
O2C8H5H7120.0°120.0°
O2C8H6H7120.0°120.0°
N4C18C17C19122.1°119.8°
N4C18C17H14119.2°120.3°
N4C18C19H14118.1°120.3°
N4C18C17N344.6°57.1°
N4C18C17C21168.0°62.9°
N4C18C19C20169.2°62.9°
N4C18C17H1374.0°177.2°
N4C18C19H1570.5°177.2°
N4C18C19H1648.8°57.1°
O2C5C4C6179.6°179.8°
O2C5C4C3179.7°180.0°
O2C5C6C1179.3°179.8°
O2C5C6H10.7°0.2°
C5O2C8H5180.0°60.0°
C5O2C8H660.0°60.0°
C5O2C8H760.0°180.0°
C4C5C6C10.3°0.4°
C5C4C3C9178.7°180.0°
C5C4C3C20.1°0.1°
C4C5C6H1179.8°180.0°
C6C5C4C30.1°0.2°
C5C6C1H1180.0°179.5°
C5C6C1C20.8°0.4°
C5C6C1O1179.8°179.8°
C4C3C9C10114.5°65.2°
C4C3C9C2178.9°179.9°
C4C3C9C1467.0°115.0°
C4C3C2C10.7°0.1°
C4C3C2CL1179.6°180.0°
N1C15C11H11180.0°179.9°
N1C15C11C10179.1°180.0°
N1C15C11C121.1°0.0°
C15N1C16N3179.6°180.0°
C15N1C16N20.0°0.0°
C11C15N1C161.3°0.0°
C15C11C10C12179.8°180.0°
C15C11C10C9178.2°180.0°
C15C11C12N20.4°0.0°
C15C11C12C13179.6°180.0°
C15C11C10H81.8°0.0°
C17C18C19H14118.7°119.9°
C18C17N3C16157.2°155.3°
C18C17N3C21123.2°119.7°
C18C17N3H13118.1°120.2°
C18C17C21H13118.0°120.0°
C17C18C19C2046.0°56.9°
C18C17C21O354.8°57.6°
C18C17N3H1235.1°24.7°
C17C18C19H15166.4°63.0°
C17C18C19H1674.4°176.9°
C18C17C21H19175.0°62.4°
C18C17C21H2065.4°177.6°
C17C18N4H2180.4°24.9°
C19C18C17N377.4°176.9°
C19C18C17C2145.9°56.9°
C18C19C20H15120.4°119.9°
C18C19C20H16120.3°119.9°
C18C19C20O354.4°57.6°
C19C18C17H13163.9°63.0°
C18C19H15H16118.9°120.1°
C18C19C20H1765.8°177.6°
C18C19C20H18174.7°62.4°
C19C18N4H2143.3°94.6°
N1C16N3N2179.7°180.0°
N1C16N3C17162.5°0.0°
N1C16N2C121.4°0.0°
C16N1C15H11178.7°180.0°
N1C16N3H1240.4°180.0°
C11C10C9H8180.0°180.0°
C11C10C9C3177.6°180.0°
C11C10C9C141.0°0.2°
C10C11C12N2179.4°180.0°
C10C11C12C130.6°0.0°
C10C11C15H110.9°0.0°
C9C10C11C122.0°0.0°
C10C9C3C14178.6°179.8°
C10C9C3C264.4°114.7°
C10C9C14C131.5°0.5°
C10C9C14H10178.5°179.8°
C11C12N2C161.6°0.0°
C11C12N2C13180.0°180.0°
C11C12C13C141.9°0.3°
C12C11C10H8178.0°180.0°
C11C12C13H9178.1°180.0°
C12C11C15H11178.9°180.0°
C16N3C17H12122.1°180.0°
C16N3C17C2179.6°85.0°
N3C16N2C12178.2°180.0°
C16N3C17H1339.1°35.1°
N2C16N3C1717.9°179.9°
C16N2C12C13178.5°180.0°
N2C16N3H12139.9°0.1°
N3C17C21H13119.2°120.1°
N3C17C21O368.1°177.5°
N3C17C18H14163.9°63.2°
N3C17C21H1952.2°57.6°
N3C17C21H20171.7°62.5°
C17C21O3H19120.2°119.9°
C17C21O3H20120.2°120.0°
C17C21O3C2064.3°61.1°
C21C17N3H12158.4°95.0°
C21C17C18H1472.8°176.9°
C17C21H19H20119.3°120.1°
C6C1C2C31.0°0.2°
C6C1C2O1179.4°179.8°
C6C1C2CL1179.3°179.8°
C6C1O1C75.7°0.2°
C3C9C14C13179.9°179.7°
C9C3C2C1178.2°180.0°
C9C3C2CL11.5°0.1°
C3C9C10H82.4°0.0°
C3C9C14H100.1°0.0°
C2C3C9C14114.2°65.1°
C3C2C1CL1179.7°179.9°
C3C2C1O1179.5°180.0°
C9C14C13C122.9°0.5°
C9C14C13H10180.0°179.8°
C14C9C10H8179.0°179.8°
C9C14C13H9177.1°179.8°
N2C12C13C14178.2°179.8°
N2C12C13H91.8°0.1°
C12C13C14H9180.0°179.7°
C12C13C14H10177.1°179.7°
C19C20O3C2163.9°61.1°
C19C20O3H17120.2°120.0°
C19C20O3H18120.2°119.9°
C20C19C18H1472.7°176.8°
C20C19H15H16119.0°120.2°
C19C20H17H18119.3°120.0°
C2C1O1C7174.9°180.0°
C2C1C6H1179.2°180.0°
O1C1C2CL10.1°0.1°
O1C1C6H10.2°0.2°
C1O1C7H2180.0°179.9°
C1O1C7H360.0°60.0°
C1O1C7H460.0°60.0°
O3C21C17H13172.8°62.4°
C21O3C20H1756.4°178.8°
C21O3C20H18175.9°58.8°
O3C21H19H20119.3°120.0°
O1C7H2H3120.0°120.1°
O1C7H2H4120.0°120.0°
O1C7H3H4120.0°120.0°
O3C20C19H15174.8°62.3°
O3C20C19H1665.9°177.5°
O3C20H17H18119.3°120.0°
C20O3C21H19175.5°58.8°
C20O3C21H2056.0°178.9°
H2C7H3H4120.0°119.9°
H5C8H6H7120.0°120.0°
H9C13C14H102.9°0.0°
H12N3C17H1382.9°144.9°
H13C17C18H1445.3°56.9°
H13C17C21H1967.0°177.7°
H13C17C21H2052.5°57.6°
H14C18C19H1547.7°56.9°
H14C18C19H16166.9°63.2°
H14C18N4H21160.9°145.1°
H15C19C20H1754.6°57.7°
H15C19C20H1865.0°177.7°
H16C19C20H17173.9°62.5°
H16C19C20H1854.3°57.5°
H22C23C24H2459.5°180.0°
H22C23C24H2560.5°60.0°
H22C23C24H26179.6°60.0°
H23C23C24H2459.6°60.0°
H23C23C24H25179.6°179.9°
H23C23C24H2660.5°60.0°
H24C24H25H26120.0°120.0°

223532

PDB entries from 2024-08-07

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