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0R2

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C27C24sing1.53Å1.54Å
O3C14doub1.21Å1.34Å
O1C11doub1.21Å1.21Å
C25C24sing1.53Å1.52Å
C10C23sing1.53Å1.55Å
C10C8sing1.53Å1.60Å
C24O5sing1.45Å1.51Å
C24C26sing1.53Å1.53Å
C14C13sing1.51Å1.54Å
C14O2sing1.34Å1.20Å
C11C12sing1.50Å1.56Å
C11N1sing1.33Å1.38Å
C13C12sing1.53Å1.54Å
O5C9sing1.34Å1.41Å
C12C15sing1.53Å1.52Å
C9O4doub1.21Å1.22Å
C9C8sing1.51Å1.64Å
C8N1sing1.46Å1.45Å
N1C7sing1.46Å1.45Å
C15C16sing1.53Å1.51Å
C7C16sing1.53Å1.58Å
C7C6sing1.51Å1.53Å
C16C17sing1.51Å1.53Å
C3C6doub1.38Å1.41ÅAromatic
C3C2sing1.38Å1.42ÅAromatic
C6C5sing1.38Å1.42ÅAromatic
C2C1doub1.38Å1.41ÅAromatic
C17C18doub1.38Å1.41ÅAromatic
C17C22sing1.38Å1.42ÅAromatic
C5C4doub1.38Å1.40ÅAromatic
C18C19sing1.38Å1.40ÅAromatic
C1C4sing1.38Å1.42ÅAromatic
C1CL1sing1.74Å1.79Å
C22C21doub1.38Å1.39ÅAromatic
C19C20doub1.38Å1.40ÅAromatic
C21C20sing1.38Å1.39ÅAromatic
C21CL2sing1.74Å1.71Å
C2H1sing1.08Å1.08Å
C3H2sing1.08Å1.08Å
C4H3sing1.08Å1.08Å
C5H4sing1.08Å1.08Å
C7H5sing1.09Å1.10Å
C8H6sing1.09Å1.10Å
C12H7sing1.09Å1.10Å
C13H8sing1.09Å1.10Å
C13H9sing1.09Å1.10Å
O2H10sing0.97Å0.95Å
C15H11sing1.09Å1.10Å
C15H12sing1.09Å1.10Å
C16H13sing1.09Å1.10Å
C18H14sing1.08Å1.08Å
C19H15sing1.08Å1.08Å
C20H16sing1.08Å1.08Å
C22H17sing1.08Å1.08Å
C10H18sing1.09Å1.10Å
C10H19sing1.09Å1.10Å
C23H20sing1.09Å1.10Å
C23H21sing1.09Å1.10Å
C23H22sing1.09Å1.10Å
C25H23sing1.09Å1.10Å
C25H24sing1.09Å1.10Å
C25H25sing1.09Å1.10Å
C26H26sing1.09Å1.10Å
C26H27sing1.09Å1.10Å
C26H28sing1.09Å1.10Å
C27H29sing1.09Å1.10Å
C27H30sing1.09Å1.10Å
C27H31sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C27C24C25110.3°109.4°
C27C24O5103.9°109.4°
C27C24C26120.4°109.5°
C24C27H29109.5°109.5°
C24C27H30109.5°109.4°
C24C27H31109.4°109.5°
O3C14C13115.4°120.0°
O3C14O2123.4°120.0°
O1C11C12120.2°118.3°
O1C11N1120.4°118.2°
C25C24O5102.8°109.5°
C25C24C26111.9°109.5°
C24C25H23109.5°109.5°
C24C25H24109.5°109.4°
C24C25H25109.5°109.5°
C23C10C8113.0°109.5°
C23C10H18108.6°109.4°
C23C10H19108.6°109.5°
C10C23H20109.5°109.5°
C10C23H21109.4°109.5°
C10C23H22109.5°109.5°
C10C8C9114.3°109.5°
C10C8N1115.3°109.5°
C10C8H6110.2°109.4°
C8C10H18108.6°109.5°
C8C10H19108.6°109.5°
O5C24C26105.5°109.5°
C24O5C9125.1°117.0°
C24C26H26109.5°109.4°
C24C26H27109.5°109.5°
C24C26H28109.5°109.5°
C13C14O2121.1°120.0°
C14C13C12112.3°109.5°
C14C13H8108.8°109.5°
C14C13H9108.8°109.5°
C14O2H10109.5°117.0°
C12C11N1119.3°123.5°
C11C12C13108.2°109.4°
C11C12C15111.3°109.9°
C11C12H7107.1°109.4°
C11N1C8119.8°117.9°
C11N1C7125.6°124.1°
C13C12C15114.9°109.4°
C13C12H7107.3°109.3°
C12C13H8108.7°109.5°
C12C13H9108.8°109.5°
O5C9O4125.9°120.0°
O5C9C8108.6°120.0°
C12C15C16111.5°108.5°
C15C12H7107.7°109.4°
C12C15H11108.9°109.7°
C12C15H12109.0°109.7°
O4C9C8125.5°120.0°
C9C8N194.2°109.5°
C9C8H6109.7°109.5°
C8N1C7114.5°118.0°
N1C8H6112.3°109.4°
N1C7C16114.2°110.5°
N1C7C6112.1°109.2°
N1C7H5106.3°109.2°
C15C16C7110.2°108.7°
C15C16C17115.1°109.6°
C16C15H11109.0°109.7°
C16C15H12108.9°109.7°
C15C16H13105.6°109.6°
C16C7C6113.0°109.3°
C7C16C17114.6°109.6°
C16C7H5104.9°109.3°
C7C16H13104.8°109.6°
C7C6C3119.4°119.9°
C7C6C5119.9°120.0°
C6C7H5105.4°109.3°
C16C17C18120.9°120.0°
C16C17C22120.9°120.0°
C17C16H13105.4°109.7°
C6C3C2118.6°120.0°
C3C6C5120.6°120.1°
C6C3H2120.7°120.1°
C3C2C1120.9°120.0°
C3C2H1119.5°120.0°
C2C3H2120.7°120.0°
C6C5C4120.7°120.0°
C6C5H4119.7°120.0°
C2C1C4120.3°120.0°
C2C1CL1115.4°120.0°
C1C2H1119.6°120.1°
C18C17C22118.1°120.0°
C17C18C19121.0°120.0°
C17C18H14119.5°120.0°
C17C22C21120.3°120.0°
C17C22H17119.9°120.0°
C5C4C1118.9°120.0°
C5C4H3120.6°120.0°
C4C5H4119.6°120.0°
C18C19C20119.8°120.0°
C19C18H14119.5°120.0°
C18C19H15120.1°120.0°
C4C1CL1124.3°120.0°
C1C4H3120.5°120.0°
C22C21C20121.3°120.0°
C22C21CL2119.5°120.1°
C21C22H17119.8°120.0°
C19C20C21119.5°119.9°
C20C19H15120.1°120.0°
C19C20H16120.3°120.0°
C20C21CL2119.2°120.0°
C21C20H16120.2°120.0°
H8C13H9109.5°109.5°
H11C15H12109.4°109.7°
H18C10H19109.4°109.5°
H20C23H21109.5°109.5°
H20C23H22109.5°109.4°
H21C23H22109.5°109.4°
H23C25H24109.5°109.5°
H23C25H25109.5°109.5°
H24C25H25109.5°109.5°
H26C26H27109.5°109.4°
H26C26H28109.4°109.4°
H27C26H28109.5°109.5°
H29C27H30109.5°109.5°
H29C27H31109.5°109.5°
H30C27H31109.4°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C27C24C25O5110.3°119.9°
C27C24C25C26137.0°120.0°
C27C24O5C26127.6°120.0°
C27C24O5C964.4°179.9°
C27C24C25H23180.0°180.0°
C27C24C25H2460.0°60.0°
C27C24C25H2560.0°60.0°
C27C24C26H26180.0°60.0°
C27C24C26H2760.0°60.0°
C27C24C26H2860.0°179.9°
C24C27H29H30120.0°120.0°
C24C27H29H31120.0°120.0°
C24C27H30H31119.9°119.9°
O3C14C13O2178.7°179.9°
O3C14C13C1279.2°0.1°
O3C14C13H8160.4°120.1°
O3C14C13H941.3°120.0°
O3C14O2H100.0°0.1°
O1C11C12N1176.9°179.9°
O1C11C12C1376.7°77.4°
O1C11C12C15156.2°162.5°
O1C11N1C84.5°2.2°
O1C11N1C7179.9°177.8°
O1C11C12H738.7°42.3°
C25C24O5C26117.4°120.0°
C25C24O5C9179.5°60.0°
C24C25H23H24120.0°120.0°
C24C25H23H25120.0°120.0°
C24C25H24H25120.0°120.0°
C25C24C26H2647.9°180.0°
C25C24C26H2772.2°60.0°
C25C24C26H28167.9°60.1°
C25C24C27H29180.0°60.0°
C25C24C27H3060.0°60.1°
C25C24C27H3160.0°180.0°
C23C10C8H18120.6°120.0°
C23C10C8H19120.5°120.0°
C23C10C8C9177.3°156.0°
C23C10C8N175.2°36.0°
C23C10C8H653.2°83.9°
C23C10H18H19118.4°119.9°
C10C23H20H21120.0°120.0°
C10C23H20H22120.0°120.0°
C10C23H21H22120.0°120.0°
C10C8N1C1143.3°41.9°
C10C8C9O562.4°60.0°
C10C8C9O4118.9°120.0°
C10C8C9N1120.2°120.0°
C10C8C9H6124.3°120.0°
C10C8N1H6127.4°119.9°
C10C8N1C7140.7°138.2°
C8C10H18H19118.4°120.0°
C8C10C23H20180.0°159.3°
C8C10C23H2160.0°39.2°
C8C10C23H2260.0°80.7°
C24O5C9O49.9°0.0°
C24O5C9C8171.4°180.0°
O5C24C25H2369.7°60.0°
O5C24C25H2450.3°180.0°
O5C24C25H25170.2°60.0°
O5C24C26H2663.1°60.0°
O5C24C26H27176.8°180.0°
O5C24C26H2856.8°59.9°
O5C24C27H2970.5°60.0°
O5C24C27H30169.5°180.0°
O5C24C27H3149.5°60.1°
C26C24O5C963.1°60.0°
C26C24C25H2343.0°60.0°
C26C24C25H24163.0°60.0°
C26C24C25H2577.0°180.0°
C24C26H26H27120.0°120.0°
C24C26H26H28120.0°120.0°
C24C26H27H28120.0°120.1°
C26C24C27H2947.2°180.0°
C26C24C27H3072.8°59.9°
C26C24C27H31167.2°60.0°
C14C13C12C11157.2°65.0°
C14C13C12H8120.4°120.0°
C14C13C12H9120.4°120.0°
C14C13C12C1577.8°174.6°
C14C13C12H741.9°54.8°
C14C13H8H9118.7°120.0°
C13C14O2H10178.6°180.0°
O2C14C13C12102.1°180.0°
O2C14C13H818.3°60.1°
O2C14C13H9137.4°59.9°
C11C12C13C15125.0°120.4°
C11C12C13H7115.3°119.8°
C11C12C15H7117.1°120.1°
C12C11N1C8172.4°177.8°
C12C11N1C73.1°2.3°
C11C12C15C1652.6°48.9°
C11C12C13H882.4°55.0°
C11C12C13H936.7°175.0°
C11C12C15H1167.7°70.9°
C11C12C15H12172.9°168.6°
N1C11C12C13106.5°102.5°
N1C11C12C1520.7°17.6°
C11N1C8C976.0°78.2°
C11N1C8C7175.9°179.9°
C11N1C7C164.6°19.2°
C11N1C7C6134.8°139.4°
C11N1C7H5110.5°101.1°
C11N1C8H6170.7°161.8°
N1C11C12H7138.1°137.7°
C13C12C15H7119.5°119.7°
C13C12C15C1670.8°71.2°
C12C13H8H9118.7°120.0°
C13C12C15H11168.9°169.0°
C13C12C15H1249.5°48.5°
O5C9O4C8178.5°179.9°
O5C9C8N1177.5°180.0°
O5C9C8H662.0°60.0°
C12C15C16H11120.3°119.8°
C12C15C16H12120.4°119.7°
C12C15C16C760.3°67.5°
C12C15C16C17168.1°172.7°
C15C12C13H842.6°65.4°
C15C12C13H9161.7°54.6°
C12C15H11H12119.1°120.5°
C12C15C16H1352.3°52.2°
O4C9C8N11.2°0.0°
O4C9C8H6116.7°120.0°
C9C8N1H6113.3°120.0°
C9C8N1C799.9°101.7°
C9C8C10H1856.7°36.1°
C9C8C10H1962.2°83.9°
C8N1C7C16179.7°160.9°
C8N1C7C649.6°40.7°
C8N1C7H565.1°78.8°
N1C8C10H18164.2°84.0°
N1C8C10H1945.3°156.0°
N1C7C16C1535.7°50.8°
N1C7C16C6129.7°120.2°
N1C7C16H5116.0°120.2°
N1C7C6H5115.2°119.4°
N1C7C16C17167.5°170.6°
N1C7C6C359.5°117.2°
N1C7C6C5123.3°63.2°
C7N1C8H613.4°18.3°
N1C7C16H1377.5°68.9°
C15C16C7C17131.8°119.8°
C15C16C7H13113.2°119.7°
C15C16C7C6165.4°171.0°
C15C16C17H13115.9°120.4°
C15C16C17C1836.6°120.8°
C15C16C17C22147.6°59.5°
C15C16C7H580.3°69.4°
C16C15C12H7169.7°169.0°
C16C15H11H12119.0°120.5°
C16C7C6H5114.1°119.6°
C7C16C17H13114.7°120.5°
C16C7C6C371.3°121.8°
C16C7C6C5105.9°57.9°
C7C16C17C1892.7°120.0°
C7C16C17C2283.0°59.7°
C7C16C15H1160.0°52.2°
C7C16C15H12179.3°172.7°
C6C7C16C1762.9°69.2°
C7C6C3C5177.1°179.6°
C7C6C3C2177.1°179.9°
C7C6C5C4177.0°179.8°
C7C6C3H22.9°0.0°
C7C6C5H43.0°0.4°
C6C7C16H1352.2°51.3°
C16C17C18C22175.9°179.7°
C16C17C18C19175.0°180.0°
C16C17C22C21174.8°179.7°
C17C16C7H551.5°50.4°
C17C16C15H1171.6°67.6°
C17C16C15H1247.8°52.9°
C16C17C18H145.0°0.0°
C16C17C22H175.2°0.0°
C6C3C2H2180.0°180.0°
C6C3C2C10.1°0.0°
C3C6C5C40.1°0.6°
C6C3C2H1180.0°180.0°
C3C6C5H4179.9°180.0°
C3C6C7H5174.7°2.2°
C2C3C6C50.1°0.3°
C3C2C1H1180.0°180.0°
C3C2C1C40.1°0.0°
C3C2C1CL1178.1°179.7°
C6C5C4H4180.0°179.4°
C6C5C4C10.1°0.6°
C5C6C3H2179.9°179.7°
C6C5C4H3179.9°179.4°
C5C6C7H58.2°177.5°
C2C1C4C50.1°0.3°
C2C1C4CL1178.0°179.8°
C1C2C3H2179.9°180.0°
C2C1C4H3179.9°179.7°
C17C18C19H14180.0°180.0°
C18C17C22C211.1°0.5°
C17C18C19C200.2°0.0°
C18C17C16H13152.5°0.4°
C17C18C19H15179.7°179.9°
C18C17C22H17178.9°179.7°
C22C17C18C190.9°0.2°
C17C22C21H17180.0°179.7°
C17C22C21C200.6°0.6°
C17C22C21CL2178.5°179.7°
C22C17C16H1331.7°179.9°
C22C17C18H14179.1°179.7°
C5C4C1H3180.0°180.0°
C5C4C1CL1177.9°180.0°
C18C19C20H15180.0°179.9°
C18C19C20C210.3°0.0°
C18C19C20H16179.7°179.9°
C4C1C2H1179.9°180.0°
C1C4C5H4179.9°180.0°
CL1C1C2H11.9°0.3°
CL1C1C4H32.1°0.0°
C22C21C20C190.1°0.3°
C22C21C20CL2179.1°179.7°
C22C21C20H16179.9°179.8°
C19C20C21H16180.0°180.0°
C19C20C21CL2179.2°180.0°
C20C19C18H14179.8°180.0°
C21C20C19H15179.7°179.9°
C20C21C22H17179.4°179.7°
CL2C21C20H160.8°0.1°
CL2C21C22H171.5°0.0°
H1C2C3H20.0°0.0°
H3C4C5H40.1°0.0°
H5C7C16H13166.6°170.9°
H6C8C10H1867.3°156.1°
H6C8C10H19173.8°36.1°
H7C12C13H8162.3°174.8°
H7C12C13H978.5°65.2°
H7C12C15H1149.3°49.3°
H7C12C15H1270.0°71.2°
H11C15C16H13172.6°172.0°
H12C15C16H1368.0°67.5°
H14C18C19H150.2°0.1°
H15C19C20H160.2°0.0°
H18C10C23H2059.4°80.7°
H18C10C23H2160.5°159.2°
H18C10C23H22179.4°39.3°
H19C10C23H2059.5°39.2°
H19C10C23H21179.4°80.8°
H19C10C23H2260.5°159.2°
H20C23H21H22120.0°119.9°
H23C25H24H25120.0°120.0°
H26C26H27H28119.9°120.0°
H29C27H30H31120.0°120.0°

222415

PDB entries from 2024-07-10

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