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A1AE4

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C12C11doub1.38Å1.40ÅAromatic
C12C13sing1.38Å1.40ÅAromatic
C11C10sing1.38Å1.40ÅAromatic
C13C14doub1.38Å1.40ÅAromatic
C10C09doub1.40Å1.42ÅAromatic
C14C09sing1.39Å1.42ÅAromatic
C09C07sing1.48Å1.50Å
C01O02sing1.43Å1.43Å
C08C07doub1.39Å1.41ÅAromatic
C08C03sing1.39Å1.40ÅAromatic
C07N06sing1.33Å1.34ÅAromatic
O02C03sing1.36Å1.38Å
C03C04doub1.41Å1.40ÅAromatic
N06C05doub1.31Å1.34ÅAromatic
C05C04sing1.40Å1.39ÅAromatic
C04C15sing1.47Å1.48Å
C15O16doub1.22Å1.21Å
C15N17sing1.35Å1.36Å
N17C18sing1.39Å1.41Å
C18C28doub1.39Å1.40ÅAromatic
C18C19sing1.39Å1.40ÅAromatic
C28C27sing1.39Å1.39ÅAromatic
C19C20doub1.37Å1.40ÅAromatic
C36C35sing1.53Å1.54Å
C27N26sing1.38Å1.33Å
C27C21doub1.41Å1.40ÅAromatic
N26C25sing1.36Å1.33Å
C20C21sing1.39Å1.41ÅAromatic
C34C33doub1.38Å1.40ÅAromatic
C34C29sing1.40Å1.42ÅAromatic
C33C32sing1.38Å1.41ÅAromatic
C21C22sing1.47Å1.39Å
C25C29sing1.48Å1.50Å
C25N24doub1.31Å1.33Å
C29C30doub1.40Å1.41ÅAromatic
C32C35sing1.51Å1.55Å
C32C31doub1.38Å1.41ÅAromatic
C35C37sing1.53Å1.54Å
C35O38sing1.43Å1.41Å
C30C31sing1.38Å1.40ÅAromatic
C22N24sing1.34Å1.31Å
C22O23doub1.22Å1.34Å
C12H1sing1.08Å1.08Å
C13H2sing1.08Å1.08Å
C14H3sing1.08Å1.08Å
C20H4sing1.08Å1.08Å
C28H5sing1.08Å1.08Å
C01H6sing1.09Å1.10Å
C01H7sing1.09Å1.10Å
C01H8sing1.09Å1.10Å
C05H9sing1.08Å1.08Å
C08H10sing1.08Å1.08Å
C10H11sing1.08Å1.08Å
C11H12sing1.08Å1.08Å
N17H13sing0.97Å1.00Å
C19H14sing1.08Å1.08Å
N26H15sing0.97Å1.00Å
C30H16sing1.08Å1.08Å
C31H17sing1.08Å1.08Å
C33H18sing1.08Å1.08Å
C34H19sing1.08Å1.08Å
C36H20sing1.09Å1.10Å
C36H21sing1.09Å1.10Å
C36H22sing1.09Å1.10Å
C37H23sing1.09Å1.10Å
C37H24sing1.09Å1.10Å
C37H25sing1.09Å1.10Å
O38H26sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C11C12C13120.0°120.3°
C12C11C10120.0°120.1°
C11C12H1120.0°119.9°
C12C11H12120.0°120.0°
C12C13C14120.1°120.1°
C13C12H1120.0°119.8°
C12C13H2120.0°119.9°
C11C10C09121.1°119.9°
C11C10H11119.5°120.1°
C10C11H12120.0°119.9°
C13C14C09121.1°119.9°
C14C13H2120.0°120.0°
C13C14H3119.4°120.1°
C10C09C14117.7°119.7°
C10C09C07121.3°120.1°
C09C10H11119.5°120.1°
C14C09C07121.0°120.2°
C09C14H3119.4°120.0°
C09C07C08122.5°119.5°
C09C07N06116.3°119.5°
C01O02C03123.0°117.0°
O02C01H6109.5°109.5°
O02C01H7109.5°109.5°
O02C01H8109.5°109.5°
C07C08C03119.8°119.2°
C08C07N06121.1°120.9°
C07C08H10120.1°120.4°
C08C03O02121.9°120.9°
C08C03C04118.0°118.2°
C03C08H10120.1°120.4°
C07N06C05119.2°122.0°
O02C03C04120.1°120.9°
C03C04C05118.8°118.9°
C03C04C15124.1°120.6°
N06C05C04123.0°120.8°
N06C05H9118.5°119.6°
C05C04C15117.0°120.5°
C04C05H9118.5°119.6°
C04C15O16119.7°120.0°
C04C15N17117.5°120.0°
O16C15N17122.7°120.0°
C15N17C18129.6°120.0°
C15N17H13115.2°120.0°
N17C18C28122.2°119.7°
N17C18C19118.6°119.8°
C18N17H13115.2°120.0°
C28C18C19119.1°120.5°
C18C28C27121.2°119.5°
C18C28H5119.4°120.2°
C18C19C20120.8°120.6°
C18C19H14119.6°119.7°
C28C27N26119.6°121.8°
C28C27C21119.5°119.7°
C27C28H5119.4°120.3°
C19C20C21119.3°119.7°
C19C20H4120.4°120.1°
C20C19H14119.6°119.7°
C36C35C32110.8°109.5°
C36C35C37108.4°109.5°
C36C35O38108.0°109.4°
C35C36H20109.5°109.5°
C35C36H21109.5°109.5°
C35C36H22109.5°109.5°
N26C27C21120.8°118.5°
C27N26C25118.5°120.4°
C27N26H15120.7°119.8°
C27C21C20120.2°120.1°
C27C21C22115.7°118.1°
N26C25C29117.2°118.5°
N26C25N24124.6°122.9°
C25N26H15120.8°119.8°
C20C21C22124.1°121.8°
C21C20H4120.3°120.2°
C33C34C29121.5°119.8°
C34C33C32121.2°120.1°
C34C33H18119.4°119.9°
C33C34H19119.3°120.1°
C34C29C25121.3°120.1°
C34C29C30116.8°119.8°
C29C34H19119.2°120.1°
C33C32C35119.8°119.9°
C33C32C31117.7°120.3°
C32C33H18119.4°119.9°
C21C22N24123.1°118.4°
C21C22O23121.3°120.8°
C29C25N24118.0°118.5°
C25C29C30121.8°120.1°
C25N24C22117.2°121.8°
C29C30C31121.7°119.8°
C29C30H16119.1°120.1°
C35C32C31122.5°119.8°
C32C35C37114.2°109.5°
C32C35O38108.3°109.5°
C32C31C30121.0°120.1°
C32C31H17119.5°119.9°
C37C35O38106.8°109.4°
C35C37H23109.5°109.4°
C35C37H24109.5°109.5°
C35C37H25109.4°109.5°
C35O38H26109.5°114.0°
C31C30H16119.2°120.0°
C30C31H17119.5°120.0°
N24C22O23115.6°120.8°
H6C01H7109.4°109.5°
H6C01H8109.5°109.4°
H7C01H8109.5°109.4°
H20C36H21109.5°109.4°
H20C36H22109.5°109.4°
H21C36H22109.5°109.5°
H23C37H24109.5°109.5°
H23C37H25109.5°109.5°
H24C37H25109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C11C12C13H1180.0°179.6°
C12C11C10H12180.0°179.9°
C11C12C13C140.3°0.1°
C12C11C10C090.4°0.0°
C11C12C13H2179.8°180.0°
C12C11C10H11179.6°180.0°
C13C12C11C100.4°0.1°
C12C13C14H2180.0°179.9°
C12C13C14C090.1°0.1°
C12C13C14H3180.0°179.9°
C13C12C11H12179.6°180.0°
C11C10C09H11180.0°180.0°
C11C10C09C140.2°0.0°
C11C10C09C07179.0°180.0°
C10C11C12H1179.6°179.7°
C13C14C09C100.0°0.0°
C13C14C09H3180.0°180.0°
C13C14C09C07178.8°180.0°
C14C13C12H1179.7°179.7°
C10C09C14C07178.8°180.0°
C10C09C07C0829.7°0.3°
C10C09C07N06150.0°180.0°
C10C09C14H3180.0°179.9°
C09C10C11H12179.6°180.0°
C14C09C07C08151.5°179.7°
C14C09C07N0628.7°0.0°
C09C14C13H2179.9°180.0°
C14C09C10H11179.8°180.0°
C09C07C08N06179.8°179.8°
C09C07C08C03177.8°179.7°
C09C07N06C05176.3°180.0°
C07C09C14H31.2°0.0°
C09C07C08H102.2°0.3°
C07C09C10H111.0°0.0°
C01O02C03C088.7°0.3°
C01O02C03C04169.1°180.0°
O02C01H6H7120.0°120.0°
O02C01H6H8120.0°120.0°
O02C01H7H8120.0°120.0°
C07C08C03H10180.0°179.4°
C07C08C03O02177.0°179.8°
C07C08C03C040.8°0.5°
C08C07N06C053.5°0.3°
C03C08C07N061.9°0.5°
C08C03O02C04177.8°179.7°
C08C03C04C051.9°0.2°
C08C03C04C15177.1°179.7°
C07N06C05C042.3°0.0°
C07N06C05H9177.7°180.0°
N06C07C08H10178.1°180.0°
O02C03C04C05175.9°180.0°
O02C03C04C150.8°0.0°
C03O02C01H6180.0°180.0°
C03O02C01H760.0°60.0°
C03O02C01H860.0°60.0°
O02C03C08H103.0°0.3°
C03C04C05N060.4°0.0°
C03C04C05C15175.5°179.9°
C03C04C15O16141.2°0.1°
C03C04C15N1739.9°180.0°
C03C04C05H9179.6°180.0°
C04C03C08H10179.2°180.0°
N06C05C04H9180.0°180.0°
N06C05C04C15175.9°180.0°
C05C04C15O1634.0°180.0°
C05C04C15N17144.9°0.1°
C04C15O16N17178.8°179.9°
C04C15N17C18173.1°174.7°
C15C04C05H94.1°0.0°
C04C15N17H137.0°5.4°
O16C15N17C188.1°5.2°
O16C15N17H13171.8°174.8°
C15N17C18H13180.0°180.0°
C15N17C18C2822.4°33.8°
C15N17C18C19161.7°146.6°
N17C18C28C19175.8°179.7°
N17C18C28C27175.9°179.7°
N17C18C19C20176.9°179.8°
N17C18C28H54.1°0.3°
N17C18C19H143.0°0.3°
C18C28C27H5180.0°180.0°
C28C18C19C200.9°0.1°
C18C28C27N26177.0°180.0°
C18C28C27C210.6°0.0°
C28C18N17H13157.6°146.3°
C28C18C19H14179.0°180.0°
C19C18C28C270.1°0.0°
C18C19C20H14180.0°179.9°
C18C19C20C211.2°0.1°
C18C19C20H4178.8°179.9°
C19C18C28H5179.9°179.9°
C19C18N17H1318.3°33.4°
C28C27N26C21177.5°180.0°
C28C27N26C25178.7°180.0°
C28C27C21C200.3°0.0°
C28C27C21C22178.7°180.0°
C28C27N26H151.3°0.1°
C19C20C21C270.6°0.1°
C19C20C21H4180.0°180.0°
C19C20C21C22177.7°179.9°
C36C35C32C3360.1°90.1°
C36C35C32C37122.7°120.0°
C36C35C32O38118.4°120.0°
C36C35C32C31121.5°90.0°
C36C35C37O38116.2°119.9°
C35C36H20H21120.0°120.0°
C35C36H20H22120.0°120.0°
C35C36H21H22120.0°120.1°
C36C35C37H23180.0°180.0°
C36C35C37H2460.0°59.9°
C36C35C37H2560.0°60.0°
C36C35O38H26180.0°59.9°
C27N26C25H15180.0°180.0°
N26C27C21C20177.2°180.0°
N26C27C21C221.3°0.0°
C27N26C25C29176.5°180.0°
C27N26C25N242.5°0.0°
N26C27C28H53.0°0.0°
C21C27N26C251.2°0.0°
C27C21C20C22178.3°180.0°
C27C21C22N242.6°0.0°
C27C21C22O23179.9°180.0°
C27C21C20H4179.4°180.0°
C21C27C28H5179.4°180.0°
C21C27N26H15178.8°180.0°
N26C25C29C3422.1°0.3°
N26C25C29N24174.3°180.0°
N26C25C29C30158.7°180.0°
N26C25N24C223.7°0.0°
C20C21C22N24175.8°180.0°
C20C21C22O231.7°0.0°
C21C20C19H14178.8°180.0°
C33C34C29H19180.0°179.5°
C34C33C32H18180.0°179.7°
C33C34C29C25179.6°179.7°
C33C34C29C300.3°0.5°
C34C33C32C35179.5°179.7°
C34C33C32C311.1°0.4°
C29C34C33C320.8°0.6°
C34C29C25C30179.2°179.7°
C34C29C25N24163.6°179.8°
C34C29C30C311.1°0.3°
C34C29C30H16178.9°179.8°
C29C34C33H18179.2°179.7°
C33C32C35C31178.4°179.9°
C33C32C35C37177.2°29.9°
C33C32C35O3858.3°150.0°
C33C32C31C300.3°0.1°
C33C32C31H17179.8°180.0°
C32C33C34H19179.2°179.9°
C21C22N24C253.7°0.0°
C21C22N24O23177.7°180.0°
C22C21C20H42.3°0.0°
C25C29C30C31179.6°180.0°
C29C25N24C22177.6°180.0°
C29C25N26H153.5°0.0°
C25C29C30H160.4°0.0°
C25C29C34H190.4°0.2°
N24C25C29C3015.6°0.0°
C25N24C22O23178.6°180.0°
N24C25N26H15177.5°179.9°
C29C30C31C320.9°0.0°
C29C30C31H16180.0°180.0°
C29C30C31H17179.1°180.0°
C30C29C34H19179.7°180.0°
C32C35C37O38119.7°120.1°
C35C32C31C30178.7°180.0°
C35C32C31H171.3°0.0°
C35C32C33H180.5°0.0°
C32C35C36H20180.0°60.0°
C32C35C36H2160.0°180.0°
C32C35C36H2260.0°60.0°
C32C35C37H2356.0°60.0°
C32C35C37H24176.0°180.0°
C32C35C37H2564.0°60.0°
C32C35O38H2659.9°180.0°
C31C32C35C371.2°150.0°
C31C32C35O38120.1°30.0°
C32C31C30H17180.0°180.0°
C32C31C30H16179.1°180.0°
C31C32C33H18179.0°179.9°
C37C35C36H2054.0°60.0°
C37C35C36H21174.0°59.9°
C37C35C36H2266.0°180.0°
C35C37H23H24120.0°120.0°
C35C37H23H25120.0°120.0°
C35C37H24H25120.0°120.0°
C37C35O38H2663.5°60.0°
O38C35C36H2061.5°180.0°
O38C35C36H2158.5°60.0°
O38C35C36H22178.5°60.1°
O38C35C37H2363.8°60.0°
O38C35C37H2456.3°60.0°
O38C35C37H25176.2°180.0°
H1C12C13H20.3°0.4°
H1C12C11H120.4°0.4°
H2C13C14H30.0°0.0°
H4C20C19H141.2°0.0°
H6C01H7H8120.0°120.0°
H11C10C11H120.4°0.0°
H16C30C31H170.9°0.0°
H18C33C34H190.8°0.2°
H20C36H21H22120.0°119.9°
H23C37H24H25120.0°120.0°

247536

PDB entries from 2026-01-14

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