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72W

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C38C39sing1.53Å1.56Å
C38C19sing1.51Å1.51Å
N20C19doub1.32Å1.34ÅAromatic
N20C21sing1.32Å1.35ÅAromatic
C19C4sing1.40Å1.36ÅAromatic
C21N15doub1.32Å1.29ÅAromatic
C4N5sing1.36Å1.38ÅAromatic
C4C3doub1.41Å1.45ÅAromatic
N5C8doub1.30Å1.31ÅAromatic
N15C3sing1.33Å1.35ÅAromatic
C3N1sing1.37Å1.35ÅAromatic
C8N1sing1.36Å1.37ÅAromatic
N1C2sing1.46Å1.46Å
O31C11sing1.36Å1.31Å
O9C2sing1.44Å1.44Å
O9C13sing1.44Å1.46Å
C37C27sing1.51Å1.51Å
C37N26sing1.46Å1.49Å
O32C17sing1.36Å1.39Å
C2C6sing1.55Å1.52Å
C27C23doub1.31Å1.29Å
N26C14sing1.35Å1.31Å
C11C17doub1.39Å1.40ÅAromatic
C11C7sing1.40Å1.40ÅAromatic
C17C18sing1.38Å1.40ÅAromatic
C14C7sing1.48Å1.47Å
C14O24doub1.22Å1.25Å
C7C12doub1.40Å1.40ÅAromatic
C23C13sing1.51Å1.52Å
C13C10sing1.54Å1.55Å
C18C16doub1.40Å1.44ÅAromatic
C12C16sing1.39Å1.38ÅAromatic
C6C10sing1.55Å1.55Å
C6O25sing1.43Å1.46Å
C16C22sing1.48Å1.52Å
C28C22doub1.39Å1.38ÅAromatic
C28C34sing1.38Å1.42ÅAromatic
C10O30sing1.43Å1.40Å
C22C29sing1.39Å1.36ÅAromatic
C34C33doub1.39Å1.37ÅAromatic
C29C35doub1.38Å1.42ÅAromatic
C33C35sing1.39Å1.30ÅAromatic
C33F36sing1.35Å1.40Å
C6H1sing1.09Å1.10Å
C8H2sing1.08Å1.08Å
C10H3sing1.09Å1.10Å
C13H4sing1.09Å1.10Å
C21H5sing1.08Å1.08Å
C2H6sing1.09Å1.10Å
C23H7sing1.08Å1.08Å
C12H8sing1.08Å1.08Å
C18H9sing1.08Å1.08Å
O25H10sing0.97Å0.95Å
N26H11sing0.97Å1.00Å
C27H12sing1.08Å1.08Å
C28H13sing1.08Å1.08Å
C29H14sing1.08Å1.08Å
O30H15sing0.97Å0.95Å
O31H16sing0.97Å0.95Å
O32H17sing0.97Å0.95Å
C34H18sing1.08Å1.08Å
C35H19sing1.08Å1.08Å
C37H20sing1.09Å1.10Å
C37H21sing1.09Å1.10Å
C38H22sing1.09Å1.10Å
C38H23sing1.09Å1.10Å
C39H24sing1.09Å1.10Å
C39H25sing1.09Å1.10Å
C39H26sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C39C38C19107.0°109.5°
C39C38H22110.1°109.5°
C39C38H23110.1°109.5°
C38C39H24109.5°109.4°
C38C39H25109.4°109.5°
C38C39H26109.5°109.5°
C38C19N20120.1°120.7°
C38C19C4121.8°120.7°
C19C38H22110.1°109.5°
C19C38H23110.1°109.5°
C19N20C21119.2°121.3°
N20C19C4118.1°118.6°
N20C21N15127.2°122.4°
N20C21H5116.4°118.8°
C19C4N5133.9°134.7°
C19C4C3119.5°118.2°
C21N15C3116.1°120.5°
N15C21H5116.4°118.8°
N5C4C3106.1°107.0°
C4N5C8109.9°109.4°
C4C3N15119.4°119.0°
C4C3N1105.0°106.0°
N5C8N1108.7°110.1°
N5C8H2125.7°124.9°
N15C3N1135.5°135.0°
C3N1C8110.3°107.5°
C3N1C2123.2°126.3°
C8N1C2125.4°126.2°
N1C8H2125.6°125.0°
N1C2O9109.2°110.7°
N1C2C6113.9°110.7°
N1C2H6110.3°110.5°
O31C11C17115.6°120.0°
O31C11C7125.4°120.0°
C11O31H16109.5°114.0°
C2O9C13111.1°107.0°
O9C2C6103.3°103.5°
O9C2H6110.6°110.6°
O9C13C23111.2°109.9°
O9C13C10105.9°107.3°
O9C13H4110.5°109.9°
C27C37N26106.4°109.5°
C37C27C23123.0°120.0°
C37C27H12118.5°120.0°
C27C37H20110.2°109.5°
C27C37H21110.2°109.5°
C37N26C14120.8°120.0°
C37N26H11119.6°120.0°
N26C37H20110.2°109.4°
N26C37H21110.2°109.5°
O32C17C11118.4°119.9°
O32C17C18118.2°119.9°
C17O32H17109.5°114.0°
C2C6C10105.7°102.1°
C2C6O25110.9°110.9°
C2C6H1108.5°110.9°
C6C2H6109.5°110.6°
C27C23C13121.2°120.1°
C27C23H7119.4°120.0°
C23C27H12118.5°120.0°
N26C14C7117.8°120.0°
N26C14O24121.9°120.0°
C14N26H11119.6°120.0°
C17C11C7118.9°119.9°
C11C17C18123.4°120.1°
C11C7C14123.0°120.1°
C11C7C12117.8°119.8°
C17C18C16117.2°120.2°
C17C18H9121.4°119.9°
C7C14O24120.2°120.0°
C14C7C12119.2°120.1°
C7C12C16124.7°119.9°
C7C12H8117.6°120.1°
C23C13C10110.0°109.9°
C23C13H4109.8°109.9°
C13C23H7119.4°120.0°
C13C10C697.3°104.2°
C13C10O30111.8°110.5°
C13C10H3110.6°110.6°
C10C13H4109.3°109.9°
C18C16C12118.0°120.1°
C18C16C22119.4°119.9°
C16C18H9121.4°119.9°
C12C16C22122.6°120.0°
C16C12H8117.7°120.1°
C10C6O25114.4°110.9°
C6C10O30112.9°110.5°
C10C6H1108.1°111.0°
C6C10H3110.5°110.5°
O25C6H1109.2°110.8°
C6O25H10109.5°114.0°
C16C22C28119.0°120.1°
C16C22C29118.6°120.1°
C22C28C34117.1°119.9°
C28C22C29122.3°119.8°
C22C28H13121.4°120.0°
C28C34C33117.4°120.2°
C34C28H13121.5°120.1°
C28C34H18121.3°119.9°
O30C10H3112.8°110.4°
C10O30H15109.5°114.1°
C22C29C35119.8°119.9°
C22C29H14120.1°120.0°
C34C33C35126.8°120.1°
C34C33F36113.2°119.9°
C33C34H18121.3°119.9°
C29C35C33116.1°120.1°
C35C29H14120.1°120.0°
C29C35H19121.9°120.0°
C35C33F36119.9°119.9°
C33C35H19122.0°119.9°
H20C37H21109.5°109.5°
H22C38H23109.5°109.5°
H24C39H25109.4°109.4°
H24C39H26109.5°109.5°
H25C39H26109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C39C38C19H22119.6°120.0°
C39C38C19H23119.6°120.0°
C39C38C19N20104.4°89.2°
C39C38C19C477.8°90.0°
C39C38H22H23121.1°120.0°
C38C39H24H25120.0°120.0°
C38C39H24H26120.0°120.0°
C38C39H25H26120.0°120.0°
C38C19N20C4178.0°179.2°
C38C19N20C21178.1°179.7°
C38C19C4N54.1°0.1°
C38C19C4C3175.3°179.7°
C19C38H22H23121.2°120.0°
C19C38C39H24180.0°60.0°
C19C38C39H2560.0°60.0°
C19C38C39H2660.0°180.0°
C19N20C21N152.0°0.9°
N20C19C4N5178.0°179.1°
N20C19C4C36.8°0.5°
C19N20C21H5178.0°179.3°
N20C19C38H22136.1°30.8°
N20C19C38H2315.2°150.8°
C21N20C19C44.0°1.1°
N20C21N15H5180.0°179.9°
N20C21N15C32.7°0.1°
C19C4N5C3172.0°179.7°
C19C4N5C8174.6°179.9°
C19C4C3N157.7°0.2°
C19C4C3N1175.5°179.8°
C4C19C38H2241.8°150.0°
C4C19C38H23162.6°30.0°
C21N15C3C45.4°0.4°
C21N15C3N1179.1°180.0°
N5C4C3N15178.9°179.9°
N5C4C3N12.1°0.4°
C4N5C8N12.0°0.1°
C4N5C8H2178.0°179.7°
C3C4N5C82.5°0.2°
C4C3N15N1175.5°179.5°
C4C3N1C81.0°0.4°
C4C3N1C2167.5°179.6°
N5C8N1C30.5°0.3°
N5C8N1H2180.0°179.6°
N5C8N1C2168.8°179.7°
N15C3N1C8177.0°180.0°
N15C3N1C28.4°0.0°
C3N15C21H5177.3°180.0°
C3N1C8C2168.2°180.0°
C3N1C2O9111.0°160.9°
C3N1C2C6134.2°85.0°
C3N1C8H2179.4°180.0°
C3N1C2H610.6°37.9°
C8N1C2O955.8°19.2°
C8N1C2C659.0°95.0°
C8N1C2H6177.4°142.1°
N1C2O9C6121.5°118.6°
N1C2O9H6121.5°122.9°
N1C2O9C13131.0°158.7°
N1C2C6H6123.9°122.9°
N1C2C6C10150.4°155.7°
N1C2C6O2585.2°86.1°
N1C2C6H134.7°37.4°
C2N1C8H211.2°0.1°
O31C11C17O323.6°0.2°
O31C11C17C7176.2°180.0°
O31C11C17C18174.5°179.5°
O31C11C7C146.2°0.3°
O31C11C7C12176.6°180.0°
O9C2C6H6117.8°118.5°
C2O9C13C23103.0°146.0°
C2O9C13C1016.5°26.6°
O9C2C6C1032.2°37.1°
O9C2C6O25156.6°155.3°
O9C2C6H183.5°81.2°
C2O9C13H4134.8°92.9°
C13O9C2C69.6°40.1°
O9C13C23C2788.0°7.1°
O9C13C23C10117.0°117.9°
O9C13C23H4122.6°121.1°
O9C13C10H4119.1°119.5°
O9C13C10C633.8°2.0°
O9C13C10O3084.4°120.8°
O9C13C10H3149.0°116.7°
C13O9C2H6107.5°78.4°
O9C13C23H792.0°172.9°
C27C37N26H20119.5°120.0°
C27C37N26H21119.5°120.0°
C37C27C23H12180.0°179.9°
C27C37N26C14156.6°180.0°
C37C27C23C13178.1°180.0°
C37C27C23H71.9°0.0°
C27C37N26H1123.4°0.0°
C27C37H20H21121.4°120.0°
N26C37C27C23140.0°125.0°
C37N26C14H11180.0°180.0°
C37N26C14C7177.8°180.0°
C37N26C14O240.8°0.0°
N26C37C27H1240.0°55.0°
N26C37H20H21121.4°120.0°
O32C17C11C18178.1°179.3°
O32C17C11C7179.8°179.8°
O32C17C18C16179.9°179.9°
O32C17C18H90.1°0.8°
C2C6C10C1340.1°20.9°
C2C6C10O25122.2°118.1°
C2C6C10H1116.0°118.2°
C2C6O25H1119.5°123.6°
C2C6C10O3077.3°97.8°
C2C6C10H3155.4°139.7°
C2C6O25H10180.0°174.2°
C27C23C13H7180.0°180.0°
C27C23C13C10154.9°125.0°
C27C23C13H434.6°113.9°
C23C27C37H2020.5°5.0°
C23C27C37H21100.4°115.0°
N26C14C7C1113.0°179.7°
N26C14C7O24177.0°179.9°
N26C14C7C12164.2°0.0°
C14N26C37H2037.0°60.0°
C14N26C37H2183.9°60.0°
C17C11C7C14178.0°179.7°
C17C11C7C120.8°0.0°
C11C17C18C161.8°0.8°
C11C17C18H9178.2°179.9°
C17C11O31H16180.0°90.0°
C11C17O32H17180.0°89.3°
C7C11C17C181.7°0.5°
C11C7C14C12177.2°179.7°
C11C7C14O24170.0°0.4°
C11C7C12C163.4°0.3°
C11C7C12H8176.6°179.7°
C7C11O31H164.1°90.0°
C17C18C16H9180.0°179.2°
C17C18C16C120.6°0.5°
C17C18C16C22178.0°179.5°
C18C17O32H171.8°90.0°
C14C7C12C16179.3°179.9°
C14C7C12H80.7°0.0°
C7C14N26H112.2°0.0°
O24C14C7C1212.8°180.0°
O24C14N26H11179.1°179.9°
C7C12C16C183.2°0.0°
C7C12C16H8180.0°180.0°
C7C12C16C22179.5°180.0°
C23C13C10H4120.6°121.0°
C23C13C10C686.5°121.6°
C23C13C10O30155.3°119.7°
C23C13C10H328.8°2.8°
C13C23C27H121.9°0.0°
C13C10C6O30117.4°118.7°
C13C10C6H3115.2°118.8°
C13C10C6O25162.3°139.0°
C13C10O30H3125.3°122.6°
C13C10C6H175.8°97.3°
C10C13C23H725.0°55.0°
C13C10O30H15180.0°65.2°
C18C16C12C22177.3°180.0°
C18C16C22C2839.2°179.8°
C18C16C22C29145.1°0.0°
C18C16C12H8176.8°180.0°
C12C16C22C28143.5°0.2°
C12C16C22C2932.1°180.0°
C12C16C18H9179.4°179.7°
C10C6O25H1121.2°123.7°
C6C10O30H3126.2°122.6°
C6C10C13H4152.9°117.4°
C10C6C2H685.7°81.4°
C10C6O25H1060.6°61.5°
C6C10O30H1571.5°180.0°
O25C6C10O3044.9°20.4°
O25C6C10H382.4°102.1°
O25C6C2H638.8°36.7°
C16C22C28C29175.5°179.8°
C16C22C28C34179.2°179.7°
C16C22C29C35178.3°180.0°
C22C16C12H80.5°0.0°
C22C16C18H92.0°0.3°
C16C22C28H130.8°0.2°
C16C22C29H141.7°0.0°
C22C28C34H13180.0°180.0°
C22C28C34C334.1°0.0°
C28C22C29C356.2°0.3°
C28C22C29H14173.8°179.7°
C22C28C34H18175.9°180.0°
C34C28C22C295.4°0.0°
C28C34C33H18180.0°180.0°
C28C34C33C354.3°0.3°
C28C34C33F36178.4°179.7°
O30C10C6H1166.8°144.0°
O30C10C13H434.7°1.3°
C22C29C35H14180.0°180.0°
C22C29C35C335.7°0.6°
C29C22C28H13174.7°180.0°
C22C29C35H19174.4°180.0°
C34C33C35C295.0°0.6°
C34C33C35F36177.1°179.4°
C33C34C28H13175.9°180.0°
C34C33C35H19175.0°180.0°
C29C35C33H19180.0°179.4°
C29C35C33F36178.0°180.0°
C33C35C29H14174.4°179.4°
C35C33C34H18175.6°179.7°
F36C33C34H181.6°0.3°
F36C33C35H192.0°0.6°
H1C6C10H339.4°21.5°
H1C6C2H6158.7°160.3°
H1C6O25H1060.6°62.2°
H3C10C13H491.8°123.9°
H3C10O30H1554.7°57.4°
H4C13C23H7145.4°66.1°
H7C23C27H12178.1°180.0°
H11N26C37H20142.9°120.0°
H11N26C37H2196.1°120.0°
H12C27C37H20159.5°175.0°
H12C27C37H2179.6°65.1°
H13C28C34H184.1°0.0°
H14C29C35H195.6°0.0°
H22C38C39H2460.4°180.0°
H22C38C39H2559.6°60.0°
H22C38C39H26179.6°60.0°
H23C38C39H2460.4°60.1°
H23C38C39H25179.6°180.0°
H23C38C39H2659.6°60.0°
H24C39H25H26120.0°120.1°

226262

PDB entries from 2024-10-16

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