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JK0

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C21C22doub1.38Å1.39ÅAromatic
C21C20sing1.39Å1.40ÅAromatic
C22N23sing1.32Å1.34ÅAromatic
C20C11doub1.39Å1.41ÅAromatic
O09C05doub1.21Å1.18Å
N23C24doub1.32Å1.34ÅAromatic
C11C24sing1.38Å1.40ÅAromatic
C11C03sing1.51Å1.53Å
C05C06sing1.51Å1.54Å
C05N04sing1.35Å1.50Å
C07O08sing1.43Å1.40Å
C07C06sing1.53Å1.55Å
C03N04sing1.47Å1.48Å
C03C02sing1.51Å1.55Å
N04C10sing1.40Å1.52Å
C02N01sing1.35Å1.49Å
C02O12doub1.21Å1.20Å
C16C15doub1.38Å1.40ÅAromatic
C16C17sing1.38Å1.40ÅAromatic
C15C14sing1.38Å1.40ÅAromatic
N01C13sing1.46Å1.47Å
C10C29doub1.39Å1.41ÅAromatic
C10C25sing1.39Å1.40ÅAromatic
C17C18doub1.38Å1.39ÅAromatic
C29C28sing1.38Å1.41ÅAromatic
C14C13sing1.51Å1.55Å
C14C19doub1.38Å1.40ÅAromatic
C25C26doub1.38Å1.41ÅAromatic
C18C19sing1.38Å1.40ÅAromatic
C28C27doub1.38Å1.38ÅAromatic
C26C27sing1.38Å1.40ÅAromatic
C27C30sing1.51Å1.56Å
C30C33sing1.53Å1.54Å
C30C31sing1.53Å1.54Å
C30C32sing1.53Å1.53Å
C13H1sing1.09Å1.10Å
C13H2sing1.09Å1.10Å
C15H3sing1.08Å1.08Å
C17H4sing1.08Å1.08Å
C20H5sing1.08Å1.08Å
C21H6sing1.08Å1.08Å
C22H7sing1.08Å1.08Å
C24H8sing1.08Å1.08Å
C26H9sing1.08Å1.08Å
C28H10sing1.08Å1.08Å
C03H11sing1.09Å1.10Å
C06H12sing1.09Å1.10Å
C06H13sing1.09Å1.10Å
C07H14sing1.09Å1.10Å
C07H15sing1.09Å1.10Å
C16H16sing1.08Å1.08Å
C18H17sing1.08Å1.08Å
C19H18sing1.08Å1.08Å
C25H19sing1.08Å1.08Å
C29H20sing1.08Å1.08Å
C31H21sing1.09Å1.10Å
C31H22sing1.09Å1.10Å
C31H23sing1.09Å1.10Å
C32H24sing1.09Å1.10Å
C32H25sing1.09Å1.10Å
C32H26sing1.09Å1.10Å
C33H27sing1.09Å1.10Å
C33H28sing1.09Å1.10Å
C33H29sing1.09Å1.10Å
N01H30sing0.97Å1.00Å
O08H31sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C22C21C20119.4°119.1°
C21C22N23122.3°120.8°
C22C21H6120.3°120.4°
C21C22H7118.9°119.6°
C21C20C11118.1°118.5°
C21C20H5120.9°120.8°
C20C21H6120.3°120.5°
C22N23C24119.3°121.7°
N23C22H7118.8°119.6°
C20C11C24118.4°119.1°
C20C11C03120.6°120.5°
C11C20H5121.0°120.8°
O09C05C06116.9°120.0°
O09C05N04119.8°120.0°
N23C24C11122.5°120.7°
N23C24H8118.8°119.7°
C24C11C03121.0°120.4°
C11C24H8118.7°119.6°
C11C03N04110.5°109.5°
C11C03C02105.5°109.5°
C11C03H11111.0°109.5°
C06C05N04123.0°120.0°
C05C06C07112.9°109.5°
C05C06H12108.6°109.5°
C05C06H13108.6°109.5°
C05N04C03120.6°120.0°
C05N04C10125.2°120.0°
O08C07C06106.4°109.5°
O08C07H14110.2°109.4°
O08C07H15110.2°109.5°
C07O08H31109.5°114.0°
C07C06H12108.6°109.5°
C07C06H13108.6°109.4°
C06C07H14110.2°109.5°
C06C07H15110.2°109.5°
N04C03C02106.8°109.5°
C03N04C10114.2°120.0°
N04C03H11111.9°109.4°
C03C02N01121.9°120.0°
C03C02O12119.6°120.0°
C02C03H11110.8°109.5°
N04C10C29118.5°120.1°
N04C10C25122.7°120.0°
N01C02O12118.5°120.0°
C02N01C13120.6°120.0°
C02N01H30119.7°120.0°
C15C16C17120.4°120.0°
C16C15C14119.5°120.0°
C16C15H3120.3°120.0°
C15C16H16119.8°120.0°
C16C17C18120.4°120.0°
C16C17H4119.8°120.0°
C17C16H16119.8°120.0°
C15C14C13121.6°120.1°
C15C14C19119.9°120.0°
C14C15H3120.3°120.0°
N01C13C14115.8°109.4°
N01C13H1107.9°109.5°
N01C13H2107.8°109.5°
C13N01H30119.7°120.0°
C29C10C25118.8°119.9°
C10C29C28120.9°120.0°
C10C29H20119.6°120.0°
C10C25C26120.2°119.9°
C10C25H19119.9°120.1°
C17C18C19119.3°120.0°
C18C17H4119.8°120.0°
C17C18H17120.3°120.0°
C29C28C27119.9°120.0°
C29C28H10120.0°120.0°
C28C29H20119.6°120.0°
C13C14C19118.5°119.9°
C14C13H1107.9°109.5°
C14C13H2107.9°109.4°
C14C19C18120.5°119.9°
C14C19H18119.7°120.0°
C25C26C27120.3°120.0°
C25C26H9119.8°120.0°
C26C25H19119.9°120.0°
C19C18H17120.4°120.0°
C18C19H18119.7°120.0°
C28C27C26119.8°120.2°
C28C27C30119.5°119.9°
C27C28H10120.1°120.0°
C26C27C30120.7°119.9°
C27C26H9119.9°120.0°
C27C30C33111.1°109.5°
C27C30C31106.9°109.4°
C27C30C32110.5°109.4°
C33C30C31110.3°109.5°
C33C30C32108.5°109.5°
C30C33H27109.5°109.5°
C30C33H28109.5°109.5°
C30C33H29109.4°109.5°
C31C30C32109.6°109.5°
C30C31H21109.5°109.5°
C30C31H22109.5°109.5°
C30C31H23109.5°109.5°
C30C32H24109.5°109.5°
C30C32H25109.5°109.4°
C30C32H26109.5°109.5°
H1C13H2109.5°109.5°
H12C06H13109.5°109.5°
H14C07H15109.5°109.5°
H21C31H22109.5°109.5°
H21C31H23109.4°109.4°
H22C31H23109.5°109.4°
H24C32H25109.4°109.4°
H24C32H26109.5°109.5°
H25C32H26109.5°109.4°
H27C33H28109.5°109.5°
H27C33H29109.5°109.4°
H28C33H29109.4°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C22C21C20H6180.0°179.9°
C21C22N23H7180.0°179.9°
C22C21C20C110.3°0.0°
C21C22N23C240.4°0.2°
C22C21C20H5179.7°179.7°
C20C21C22N230.4°0.1°
C21C20C11H5180.0°179.8°
C21C20C11C240.3°0.2°
C21C20C11C03180.0°179.7°
C20C21C22H7179.6°180.0°
C22N23C24C110.4°0.5°
N23C22C21H6179.7°180.0°
C22N23C24H8179.6°180.0°
C20C11C24N230.4°0.5°
C20C11C24C03179.7°180.0°
C20C11C03N04146.4°124.5°
C20C11C03C0298.5°115.5°
C11C20C21H6179.7°180.0°
C20C11C24H8179.6°180.0°
C20C11C03H1121.7°4.5°
O09C05C06N04173.5°179.9°
O09C05C06C0778.8°4.7°
O09C05N04C031.6°5.1°
O09C05N04C10179.0°174.9°
O09C05C06H1241.7°115.3°
O09C05C06H13160.6°124.6°
N23C24C11H8180.0°179.5°
N23C24C11C03179.9°179.5°
C24N23C22H7179.6°179.8°
C24C11C03N0433.8°55.6°
C24C11C03C0281.2°64.5°
C24C11C20H5179.7°180.0°
C24C11C03H11158.6°175.5°
C11C03N04C0549.4°174.3°
C11C03N04C02114.3°120.1°
C11C03N04H11124.3°120.0°
C11C03C02H11120.3°120.0°
C11C03N04C10131.2°5.7°
C11C03C02N01140.8°59.9°
C11C03C02O1240.7°120.0°
C03C11C20H50.0°0.0°
C03C11C24H80.1°0.0°
C05C06C07O0859.2°180.0°
C05C06C07H12120.5°120.0°
C05C06C07H13120.5°120.0°
C06C05N04C03174.9°175.0°
C06C05N04C105.7°5.0°
C05C06H12H13118.4°120.0°
C05C06C07H14178.8°60.0°
C05C06C07H1560.3°60.0°
N04C05C06C07107.7°175.4°
C05N04C03C10179.4°180.0°
C05N04C03C02163.7°65.6°
C05N04C10C29105.3°110.5°
C05N04C10C2577.5°69.2°
C05N04C03H1174.9°54.3°
N04C05C06H12131.8°64.6°
N04C05C06H1312.8°55.5°
O08C07C06H14119.5°120.0°
O08C07C06H15119.5°120.0°
O08C07C06H12179.8°60.0°
O08C07C06H1361.3°60.0°
O08C07H14H15121.4°120.0°
C07C06H12H13118.4°120.0°
C06C07H14H15121.4°120.0°
C06C07O08H31180.0°180.0°
N04C03C02H11122.1°119.9°
N04C03C02N01101.6°180.0°
N04C03C02O1276.9°0.1°
C03N04C10C2974.0°69.5°
C03N04C10C25103.1°110.8°
C02C03N04C1016.9°114.3°
C03C02N01O12178.5°179.9°
C03C02N01C13178.0°180.0°
C03C02N01H302.1°0.1°
N04C10C29C25177.3°179.7°
N04C10C29C28177.5°179.7°
N04C10C25C26178.1°179.7°
C10N04C03H11104.5°125.7°
N04C10C25H191.9°0.3°
N04C10C29H202.5°0.3°
C02N01C13H30180.0°180.0°
C02N01C13C1469.6°179.9°
C02N01C13H1169.5°60.1°
C02N01C13H251.3°60.0°
N01C02C03H1120.5°60.1°
O12C02N01C130.5°0.1°
O12C02C03H11161.0°120.0°
O12C02N01H30179.4°179.9°
C15C16C17H16180.0°179.9°
C16C15C14H3180.0°179.8°
C15C16C17C180.2°0.6°
C16C15C14C13179.9°179.8°
C16C15C14C190.2°0.2°
C15C16C17H4179.8°179.8°
C17C16C15C140.0°0.1°
C16C17C18H4180.0°179.1°
C16C17C18C190.3°0.9°
C17C16C15H3179.9°179.7°
C16C17C18H17179.7°179.2°
C15C14C13N013.4°90.0°
C15C14C13C19179.7°180.0°
C15C14C19C180.2°0.0°
C15C14C13H1124.3°150.0°
C15C14C13H2117.5°30.0°
C14C15C16H16179.9°180.0°
C15C14C19H18179.8°179.9°
N01C13C14H1120.9°120.0°
N01C13C14H2120.9°120.0°
N01C13C14C19176.3°90.0°
N01C13H1H2117.1°120.0°
C10C29C28H20180.0°180.0°
C29C10C25C261.0°0.0°
C10C29C28C270.8°0.0°
C10C29C28H10179.2°180.0°
C29C10C25H19179.0°180.0°
C25C10C29C280.3°0.0°
C10C25C26H19180.0°180.0°
C10C25C26C270.6°0.0°
C10C25C26H9179.4°180.0°
C25C10C29H20179.7°180.0°
C17C18C19C140.1°0.6°
C17C18C19H17180.0°179.9°
C18C17C16H16179.8°179.5°
C17C18C19H18179.9°179.5°
C29C28C27H10180.0°180.0°
C29C28C27C261.2°0.0°
C29C28C27C30179.9°180.0°
C13C14C19C18179.9°180.0°
C14C13H1H2117.1°120.0°
C13C14C15H30.0°0.0°
C13C14C19H180.1°0.0°
C14C13N01H30110.4°0.1°
C14C19C18H18180.0°179.9°
C19C14C13H155.4°30.0°
C19C14C13H262.8°150.0°
C19C14C15H3179.7°180.0°
C14C19C18H17179.9°179.5°
C25C26C27C280.5°0.0°
C25C26C27H9180.0°180.0°
C25C26C27C30179.4°180.0°
C19C18C17H4179.7°180.0°
C28C27C26C30178.9°180.0°
C28C27C30C3352.8°120.0°
C28C27C30C3167.6°0.0°
C28C27C30C32173.2°120.0°
C28C27C26H9179.5°180.0°
C27C28C29H20179.2°180.0°
C26C27C30C33128.4°60.0°
C26C27C30C31111.3°180.0°
C26C27C30C327.9°60.1°
C26C27C28H10178.8°180.0°
C27C26C25H19179.4°180.0°
C27C30C33C31118.3°120.0°
C27C30C33C32121.6°120.0°
C27C30C31C32119.7°119.9°
C30C27C26H90.6°0.0°
C30C27C28H100.1°0.0°
C27C30C31H21180.0°60.0°
C27C30C31H2260.0°180.0°
C27C30C31H2360.0°60.0°
C27C30C32H24180.0°60.1°
C27C30C32H2560.0°180.0°
C27C30C32H2660.0°60.0°
C27C30C33H27180.0°60.0°
C27C30C33H2860.0°180.0°
C27C30C33H2960.0°60.0°
C33C30C31C32119.4°120.1°
C33C30C31H2159.1°180.0°
C33C30C31H22179.1°60.0°
C33C30C31H2360.9°60.0°
C33C30C32H2458.0°59.9°
C33C30C32H2562.0°60.0°
C33C30C32H26178.0°180.0°
C30C33H27H28120.0°120.1°
C30C33H27H29120.0°120.0°
C30C33H28H29120.0°120.0°
C30C31H21H22120.0°120.1°
C30C31H21H23120.0°120.0°
C30C31H22H23120.0°120.0°
C31C30C32H2462.5°180.0°
C31C30C32H25177.5°60.0°
C31C30C32H2657.5°59.9°
C31C30C33H2761.7°60.0°
C31C30C33H2858.3°60.0°
C31C30C33H29178.3°180.0°
C32C30C31H2160.3°60.0°
C32C30C31H2259.7°60.1°
C32C30C31H23179.7°180.0°
C30C32H24H25120.0°119.9°
C30C32H24H26120.0°120.1°
C30C32H25H26120.0°120.1°
C32C30C33H2758.4°180.0°
C32C30C33H28178.4°60.0°
C32C30C33H2961.6°60.0°
H1C13N01H3010.6°120.0°
H2C13N01H30128.7°120.0°
H3C15C16H160.1°0.2°
H4C17C16H160.2°0.3°
H4C17C18H170.3°0.1°
H5C20C21H60.3°0.2°
H6C21C22H70.3°0.0°
H9C26C25H190.6°0.0°
H10C28C29H200.8°0.0°
H12C06C07H1460.7°180.0°
H12C06C07H1560.2°60.0°
H13C06C07H1458.2°60.0°
H13C06C07H15179.2°180.0°
H14C07O08H3160.5°60.0°
H15C07O08H3160.5°60.0°
H17C18C19H180.1°0.4°
H21C31H22H23120.0°119.9°
H24C32H25H26120.0°120.0°
H27C33H28H29120.0°119.9°

224004

PDB entries from 2024-08-21

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