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9LJ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C32C33doub1.39Å1.38ÅAromatic
C32C31sing1.38Å1.39ÅAromatic
C33C34sing1.38Å1.40ÅAromatic
C31C30doub1.40Å1.40ÅAromatic
C14C13doub1.38Å1.39ÅAromatic
C14C15sing1.38Å1.38ÅAromatic
C34C29doub1.39Å1.40ÅAromatic
C30C29sing1.40Å1.42ÅAromatic
C30C35sing1.43Å1.44Å
C13C12sing1.40Å1.39ÅAromatic
CL18C15sing1.74Å1.75Å
C29N22sing1.39Å1.42Å
N11C7sing1.35Å1.40ÅAromatic
N11C10doub1.31Å1.32ÅAromatic
C35N36trip1.14Å1.14Å
C15C16doub1.38Å1.38ÅAromatic
C4C7doub1.40Å1.40ÅAromatic
C4C1sing1.38Å1.38ÅAromatic
F5C1sing1.35Å1.35Å
C7C8sing1.41Å1.39ÅAromatic
C12C10sing1.48Å1.48Å
C12C17doub1.40Å1.39ÅAromatic
C10N9sing1.37Å1.38ÅAromatic
N22C21sing1.35Å1.36Å
C1C2doub1.39Å1.39ÅAromatic
C16C17sing1.38Å1.39ÅAromatic
C8N9sing1.38Å1.40ÅAromatic
C8C3doub1.39Å1.40ÅAromatic
N9C19sing1.47Å1.48Å
C2C3sing1.38Å1.38ÅAromatic
C2F6sing1.35Å1.35Å
C21C19sing1.51Å1.59Å
C21O23doub1.21Å1.23Å
C19C20sing1.53Å1.54Å
C20C28sing1.53Å1.55Å
C20C24sing1.53Å1.53Å
C28C27sing1.53Å1.54Å
C24C25sing1.53Å1.53Å
C27C26sing1.53Å1.52Å
C25C26sing1.53Å1.52Å
C4H1sing1.08Å1.08Å
C13H2sing1.08Å1.08Å
C17H3sing1.08Å1.08Å
C20H4sing1.09Å1.10Å
C24H5sing1.09Å1.10Å
C24H6sing1.09Å1.10Å
C26H7sing1.09Å1.10Å
C26H8sing1.09Å1.10Å
C28H9sing1.09Å1.10Å
C28H10sing1.09Å1.10Å
C3H11sing1.08Å1.08Å
C19H12sing1.09Å1.10Å
C25H13sing1.09Å1.10Å
C25H14sing1.09Å1.10Å
C27H15sing1.09Å1.10Å
C27H16sing1.09Å1.10Å
N22H17sing0.97Å1.00Å
C31H18sing1.08Å1.08Å
C32H19sing1.08Å1.08Å
C33H20sing1.08Å1.08Å
C34H21sing1.08Å1.08Å
C14H22sing1.08Å1.08Å
C16H23sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C33C32C31120.3°120.3°
C32C33C34120.6°120.4°
C33C32H19119.9°119.9°
C32C33H20119.7°119.8°
C32C31C30120.1°119.9°
C32C31H18119.9°120.1°
C31C32H19119.9°119.8°
C33C34C29120.0°120.0°
C34C33H20119.7°119.8°
C33C34H21120.0°120.0°
C31C30C29120.4°119.6°
C31C30C35119.5°120.2°
C30C31H18120.0°120.0°
C13C14C15119.3°120.1°
C14C13C12121.0°119.9°
C14C13H2119.5°120.1°
C13C14H22120.4°120.0°
C14C15CL18119.1°119.9°
C14C15C16121.3°120.3°
C15C14H22120.3°119.9°
C34C29C30118.7°119.7°
C34C29N22122.3°120.1°
C29C34H21120.0°120.0°
C29C30C35120.1°120.2°
C30C29N22119.0°120.2°
C30C35N36178.1°180.0°
C13C12C10118.5°120.1°
C13C12C17118.7°119.7°
C12C13H2119.5°120.0°
CL18C15C16119.6°119.9°
C29N22C21129.1°120.1°
C29N22H17115.4°120.0°
C7N11C10105.2°109.7°
N11C7C4129.8°133.3°
N11C7C8110.5°107.2°
N11C10C12123.6°125.2°
N11C10N9112.7°109.7°
C15C16C17119.2°120.1°
C15C16H23120.4°120.0°
C7C4C1117.6°119.8°
C4C7C8119.7°119.5°
C7C4H1121.2°120.1°
C4C1F5119.2°119.8°
C4C1C2121.9°120.5°
C1C4H1121.2°120.1°
F5C1C2118.9°119.7°
C7C8N9105.1°106.2°
C7C8C3122.9°120.0°
C10C12C17122.9°120.1°
C12C10N9123.7°125.1°
C12C17C16120.6°119.9°
C12C17H3119.7°120.0°
C10N9C8106.6°107.2°
C10N9C19125.1°126.4°
N22C21C19114.1°120.0°
N22C21O23124.2°119.9°
C21N22H17115.4°120.0°
C1C2C3121.6°120.4°
C1C2F6119.0°119.8°
C16C17H3119.7°120.1°
C17C16H23120.4°119.9°
N9C8C3132.0°133.9°
C8N9C19128.3°126.4°
C8C3C2116.3°119.9°
C8C3H11121.9°120.1°
N9C19C21109.9°109.4°
N9C19C20114.0°109.5°
N9C19H12106.5°109.4°
C3C2F6119.4°119.8°
C2C3H11121.8°120.1°
C19C21O23121.6°120.0°
C21C19C20114.3°109.5°
C21C19H12105.4°109.4°
C19C20C28111.5°109.5°
C19C20C24111.3°109.5°
C19C20H4108.2°109.5°
C20C19H12106.0°109.5°
C28C20C24109.3°109.5°
C20C28C27112.2°109.5°
C28C20H4108.1°109.5°
C20C28H9108.8°109.5°
C20C28H10108.8°109.5°
C20C24C25112.1°109.4°
C24C20H4108.3°109.4°
C20C24H5108.8°109.5°
C20C24H6108.8°109.4°
C28C27C26111.3°109.5°
C27C28H9108.8°109.4°
C27C28H10108.8°109.5°
C28C27H15109.0°109.4°
C28C27H16109.0°109.5°
C24C25C26111.4°109.5°
C25C24H5108.8°109.5°
C25C24H6108.8°109.5°
C24C25H13109.0°109.5°
C24C25H14109.0°109.4°
C27C26C25111.1°109.4°
C27C26H7109.1°109.4°
C27C26H8109.1°109.4°
C26C27H15109.0°109.5°
C26C27H16109.0°109.5°
C25C26H7109.1°109.5°
C25C26H8109.1°109.5°
C26C25H13109.0°109.5°
C26C25H14109.0°109.4°
H5C24H6109.5°109.5°
H7C26H8109.5°109.5°
H9C28H10109.5°109.5°
H13C25H14109.5°109.4°
H15C27H16109.4°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C33C32C31H19180.0°179.8°
C32C33C34H20180.0°179.8°
C33C32C31C300.1°0.1°
C32C33C34C290.2°0.5°
C33C32C31H18179.9°179.9°
C32C33C34H21179.8°179.9°
C31C32C33C340.0°0.2°
C32C31C30H18180.0°179.8°
C32C31C30C290.1°0.1°
C32C31C30C35179.8°180.0°
C31C32C33H20180.0°180.0°
C33C34C29H21180.0°179.4°
C33C34C29C300.2°0.5°
C33C34C29N22180.0°179.7°
C34C33C32H19180.0°179.9°
C31C30C29C340.1°0.2°
C31C30C29C35179.9°179.9°
C31C30C29N22179.9°180.0°
C31C30C35N36179.2°118.3°
C30C31C32H19179.9°179.7°
C13C14C15H22180.0°180.0°
C14C13C12H2180.0°179.7°
C13C14C15CL18180.0°179.7°
C13C14C15C160.1°0.1°
C14C13C12C10179.6°179.8°
C14C13C12C170.1°0.3°
C15C14C13C120.0°0.0°
C14C15CL18C16179.9°179.8°
C14C15C16C170.1°0.2°
C15C14C13H2179.9°179.7°
C14C15C16H23179.9°179.9°
C34C29C30N22179.8°179.8°
C34C29C30C35180.0°179.7°
C34C29N22C21103.2°30.6°
C34C29N22H1776.9°149.5°
C29C34C33H20179.8°179.7°
C29C30C35N360.9°61.8°
C30C29N22C2177.1°149.2°
C30C29N22H17102.9°30.8°
C29C30C31H18180.0°179.9°
C30C29C34H21179.8°179.9°
C35C30C29N220.2°0.0°
C35C30C31H180.1°0.1°
C13C12C10N11103.0°148.4°
C13C12C10C17179.5°180.0°
C13C12C10N976.8°31.7°
C13C12C17C160.2°0.5°
C13C12C17H3179.8°180.0°
C12C13C14H22179.9°180.0°
CL18C15C16C17179.8°180.0°
CL18C15C14H220.0°0.2°
CL18C15C16H230.2°0.1°
C29N22C21H17180.0°179.9°
C29N22C21C19179.9°179.8°
C29N22C21O230.1°0.2°
N22C29C34H210.0°0.3°
N11C7C4C8180.0°179.9°
N11C7C4C1179.9°180.0°
C7N11C10C12179.6°180.0°
C7N11C10N90.2°0.0°
N11C7C8N90.4°0.0°
N11C7C8C3179.9°180.0°
N11C7C4H10.1°0.2°
C10N11C7C4179.9°179.9°
C10N11C7C80.2°0.0°
N11C10C12N9179.8°179.9°
N11C10C12C1777.6°31.6°
N11C10N9C80.5°0.1°
N11C10N9C19179.0°180.0°
C15C16C17C120.2°0.4°
C15C16C17H23180.0°179.9°
C15C16C17H3179.8°180.0°
C16C15C14H22179.9°180.0°
C7C4C1H1180.0°179.8°
C7C4C1F5179.8°180.0°
C7C4C1C20.2°0.0°
C4C7C8N9179.6°180.0°
C4C7C8C30.0°0.1°
C4C1F5C2180.0°180.0°
C1C4C7C80.1°0.1°
C4C1C2C30.3°0.0°
C4C1C2F6179.8°180.0°
F5C1C2C3179.7°180.0°
F5C1C2F60.2°0.0°
F5C1C4H10.2°0.2°
C7C8N9C100.5°0.1°
C7C8N9C3179.6°179.9°
C7C8N9C19179.0°180.0°
C7C8C3C20.1°0.0°
C8C7C4H1180.0°179.7°
C7C8C3H11179.9°179.9°
C10C12C17C16179.7°179.5°
C12C10N9C8179.3°180.0°
C12C10N9C190.8°0.1°
C10C12C13H20.4°0.0°
C10C12C17H30.3°0.0°
C17C12C10N9102.7°148.3°
C12C17C16H3180.0°179.5°
C17C12C13H2179.9°180.0°
C12C17C16H23179.8°179.7°
C10N9C8C19178.5°179.9°
C10N9C8C3179.9°180.0°
C10N9C19C21113.8°69.3°
C10N9C19C20116.4°170.7°
C10N9C19H120.1°50.7°
N22C21C19N929.2°166.7°
N22C21C19O23180.0°180.0°
N22C21C19C20158.8°73.3°
N22C21C19H1285.2°46.8°
C1C2C3C80.2°0.0°
C1C2C3F6179.9°180.0°
C2C1C4H1179.8°179.7°
C1C2C3H11179.8°180.0°
N9C8C3C2179.4°180.0°
C8N9C19C2164.4°110.8°
C8N9C19C2065.4°9.2°
N9C8C3H110.6°0.0°
C8N9C19H12178.1°129.2°
C3C8N9C191.4°0.1°
C8C3C2H11180.0°180.0°
C8C3C2F6179.9°180.0°
N9C19C21C20129.6°120.0°
N9C19C21H12114.4°119.9°
N9C19C21O23150.8°13.3°
N9C19C20H12116.8°120.0°
N9C19C20C2837.6°64.2°
N9C19C20C24160.0°175.8°
N9C19C20H481.1°55.8°
F6C2C3H110.1°0.0°
C21C19C20H12115.6°120.0°
C21C19C20C28165.2°175.8°
C21C19C20C2472.4°55.8°
C21C19C20H446.4°64.2°
C19C21N22H170.1°0.3°
O23C21C19C2021.2°106.7°
O23C21C19H1294.7°133.2°
O23C21N22H17179.9°179.7°
C19C20C28C24123.5°120.0°
C19C20C28H4118.9°120.1°
C19C20C24H4118.8°120.1°
C19C20C28C27177.6°180.0°
C19C20C24C25178.8°180.0°
C19C20C24H560.8°60.0°
C19C20C24H658.4°60.0°
C19C20C28H957.1°60.0°
C19C20C28H1062.0°60.0°
C28C20C24H4117.5°120.0°
C20C28C27H9120.4°120.0°
C20C28C27H10120.4°120.1°
C28C20C24C2555.2°60.0°
C20C28C27C2654.8°60.0°
C28C20C24H5175.6°180.0°
C28C20C24H665.2°60.0°
C20C28H9H10118.8°120.0°
C28C20C19H1279.2°55.8°
C20C28C27H15175.1°60.0°
C20C28C27H1665.5°180.0°
C24C20C28C2754.1°60.0°
C20C24C25H5120.4°120.0°
C20C24C25H6120.4°119.9°
C20C24C25C2657.2°60.1°
C20C24H5H6118.8°120.0°
C24C20C28H966.3°60.0°
C24C20C28H10174.5°180.0°
C24C20C19H1243.2°64.2°
C20C24C25H1363.1°60.1°
C20C24C25H14177.5°180.0°
C28C27C26H15120.3°120.0°
C28C27C26H16120.3°120.0°
C28C27C26C2555.1°60.0°
C27C28C20H463.6°60.0°
C28C27C26H765.2°180.0°
C28C27C26H8175.3°60.0°
C27C28H9H10118.7°120.0°
C28C27H15H16119.2°120.0°
C24C25C26C2756.2°60.1°
C24C25C26H13120.3°120.1°
C24C25C26H14120.3°119.9°
C25C24C20H462.4°59.9°
C25C24H5H6118.8°120.1°
C24C25C26H764.0°180.0°
C24C25C26H8176.5°59.9°
C24C25H13H14119.1°120.0°
C27C26C25H7120.2°119.9°
C27C26C25H8120.2°120.0°
C27C26H7H8119.3°120.0°
C26C27C28H965.6°60.0°
C26C27C28H10175.2°180.0°
C27C26C25H1364.1°60.0°
C27C26C25H14176.5°180.0°
C26C27H15H16119.1°120.0°
C26C25C24H5177.6°180.0°
C26C25C24H663.2°59.9°
C25C26H7H8119.3°120.1°
C26C25H13H14119.1°119.9°
C25C26C27H15175.4°60.0°
C25C26C27H1665.2°179.9°
H2C13C14H220.1°0.3°
H3C17C16H230.2°0.1°
H4C20C24H558.0°60.0°
H4C20C24H6177.3°180.0°
H4C20C28H9176.0°179.9°
H4C20C28H1056.8°60.1°
H4C20C19H12162.0°175.8°
H5C24C25H1357.3°59.9°
H5C24C25H1462.1°60.0°
H6C24C25H13176.5°NaN°
H6C24C25H1457.1°60.1°
H7C26C25H13175.7°59.9°
H7C26C25H1456.3°60.1°
H7C26C27H1555.2°60.0°
H7C26C27H16174.5°60.0°
H8C26C25H1356.2°180.0°
H8C26C25H1463.2°60.1°
H8C26C27H1564.4°180.0°
H8C26C27H1655.0°60.0°
H9C28C27H1554.7°NaN°
H9C28C27H16174.1°60.0°
H10C28C27H1564.5°60.0°
H10C28C27H1654.9°59.9°
H18C31C32H190.1°0.2°
H19C32C33H200.0°0.2°
H20C33C34H210.2°0.2°

247947

PDB entries from 2026-01-21

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