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779

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C30C29doub1.38Å1.39ÅAromatic
C30C31sing1.38Å1.38ÅAromatic
C29C28sing1.39Å1.38ÅAromatic
C31C32doub1.38Å1.38ÅAromatic
C28N27sing1.40Å1.42Å
C28C33doub1.39Å1.39ÅAromatic
N27C23sing1.35Å1.37Å
C32C33sing1.38Å1.38ÅAromatic
N22C23sing1.35Å1.39Å
N22C12sing1.46Å1.45Å
C23O26doub1.22Å1.23Å
C13C12sing1.53Å1.53Å
C13C14sing1.53Å1.53Å
C12C11sing1.53Å1.53Å
C11C8sing1.53Å1.53Å
C14C15sing1.53Å1.53Å
C15C8sing1.53Å1.53Å
C8C24sing1.53Å1.53Å
C24C2sing1.53Å1.54Å
C7C2sing1.53Å1.53Å
C7C9sing1.53Å1.54Å
C2N3sing1.47Å1.46Å
C2C1sing1.51Å1.52Å
C20C19sing1.53Å1.53Å
C20C10sing1.53Å1.53Å
C19C18sing1.53Å1.53Å
N3C4sing1.37Å1.37Å
O6C1doub1.21Å1.22Å
C1N5sing1.35Å1.37Å
C10C9sing1.53Å1.53Å
C10C16sing1.53Å1.52Å
C4N5sing1.37Å1.37Å
C4N21doub1.30Å1.29Å
C18C17sing1.53Å1.52Å
N5C25sing1.47Å1.46Å
C16C17sing1.53Å1.53Å
C7H1sing1.09Å1.10Å
C7H2sing1.09Å1.10Å
C8H3sing1.09Å1.10Å
C9H4sing1.09Å1.10Å
C9H5sing1.09Å1.10Å
C10H6sing1.09Å1.10Å
C11H7sing1.09Å1.10Å
C11H8sing1.09Å1.10Å
C12H9sing1.09Å1.10Å
C13H10sing1.09Å1.10Å
C13H11sing1.09Å1.10Å
C14H12sing1.09Å1.10Å
C14H13sing1.09Å1.10Å
C15H14sing1.09Å1.10Å
C15H15sing1.09Å1.10Å
C16H16sing1.09Å1.10Å
C16H17sing1.09Å1.10Å
C17H18sing1.09Å1.10Å
C17H19sing1.09Å1.10Å
C18H20sing1.09Å1.10Å
C18H21sing1.09Å1.10Å
C19H22sing1.09Å1.10Å
C19H23sing1.09Å1.10Å
C20H24sing1.09Å1.10Å
C20H25sing1.09Å1.10Å
N21H26sing0.97Å1.00Å
N22H28sing0.97Å1.00Å
C24H29sing1.09Å1.10Å
C24H30sing1.09Å1.10Å
C25H31sing1.09Å1.10Å
C25H32sing1.09Å1.10Å
C25H33sing1.09Å1.10Å
N27H34sing0.97Å1.00Å
C29H35sing1.08Å1.08Å
C30H36sing1.08Å1.08Å
C31H37sing1.08Å1.08Å
C32H38sing1.08Å1.08Å
C33H39sing1.08Å1.08Å
N3H40sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C29C30C31120.1°120.1°
C30C29C28120.1°119.9°
C30C29H35120.0°120.1°
C29C30H36120.0°120.0°
C30C31C32120.2°120.1°
C31C30H36119.9°119.9°
C30C31H37119.9°119.9°
C29C28N27117.2°120.0°
C29C28C33119.4°119.9°
C28C29H35119.9°120.0°
C31C32C33119.7°120.0°
C32C31H37119.9°119.9°
C31C32H38120.2°120.0°
N27C28C33123.5°120.1°
C28N27C23127.0°119.9°
C28N27H34116.5°120.1°
C28C33C32120.5°120.0°
C28C33H39119.7°120.1°
N27C23N22111.8°120.0°
N27C23O26125.2°120.0°
C23N27H34116.5°120.0°
C33C32H38120.2°120.0°
C32C33H39119.7°120.0°
C23N22C12119.9°120.0°
N22C23O26123.0°120.0°
C23N22H28120.0°120.0°
N22C12C13109.7°109.5°
N22C12C11112.4°109.5°
N22C12H9107.9°109.5°
C12N22H28120.0°120.0°
C12C13C14111.5°109.5°
C13C12C11112.5°109.4°
C13C12H9107.0°109.5°
C12C13H10108.9°109.5°
C12C13H11108.9°109.5°
C13C14C15111.7°109.5°
C14C13H10108.9°109.5°
C14C13H11109.0°109.5°
C13C14H12108.9°109.5°
C13C14H13108.9°109.4°
C12C11C8111.8°109.5°
C12C11H7108.9°109.4°
C12C11H8108.9°109.4°
C11C12H9107.0°109.5°
C11C8C15110.9°109.5°
C11C8C24111.2°109.5°
C11C8H3108.0°109.5°
C8C11H7108.9°109.5°
C8C11H8108.9°109.5°
C14C15C8110.0°109.5°
C15C14H12108.9°109.5°
C15C14H13108.9°109.5°
C14C15H14109.3°109.5°
C14C15H15109.4°109.5°
C15C8C24110.6°109.4°
C15C8H3108.0°109.5°
C8C15H14109.4°109.5°
C8C15H15109.3°109.5°
C8C24C2116.7°109.5°
C24C8H3108.0°109.5°
C8C24H29107.6°109.5°
C8C24H30107.6°109.5°
C24C2C7109.1°110.5°
C24C2N3113.4°110.4°
C24C2C1112.2°110.5°
C2C24H29107.7°109.5°
C2C24H30107.7°109.4°
C2C7C9115.1°109.5°
C7C2N3109.4°110.5°
C7C2C1110.7°110.5°
C2C7H1108.1°109.5°
C2C7H2108.0°109.5°
C7C9C10114.7°109.5°
C9C7H1108.0°109.4°
C9C7H2108.0°109.4°
C7C9H4108.1°109.5°
C7C9H5108.1°109.5°
N3C2C1101.9°104.4°
C2N3C4111.0°106.6°
C2N3H40124.5°126.7°
C2C1O6125.3°126.7°
C2C1N5107.0°106.5°
C19C20C10110.8°109.5°
C20C19C18113.1°109.5°
C20C19H22108.5°109.4°
C20C19H23108.5°109.5°
C19C20H24109.1°109.5°
C19C20H25109.2°109.5°
C20C10C9113.4°109.5°
C20C10C16109.7°109.5°
C20C10H6108.3°109.5°
C10C20H24109.2°109.4°
C10C20H25109.1°109.5°
C19C18C17112.2°109.5°
C19C18H20108.8°109.4°
C19C18H21108.8°109.4°
C18C19H22108.6°109.4°
C18C19H23108.6°109.5°
N3C4N5108.3°111.2°
N3C4N21127.3°124.4°
C4N3H40124.5°126.7°
O6C1N5127.7°126.8°
C1N5C4111.8°111.3°
C1N5C25122.7°124.4°
C9C10C16108.7°109.5°
C10C9H4108.1°109.4°
C10C9H5108.2°109.4°
C9C10H6108.2°109.4°
C10C16C17113.0°109.4°
C16C10H6108.3°109.5°
C10C16H16108.6°109.5°
C10C16H17108.6°109.4°
N5C4N21124.4°124.4°
C4N5C25125.4°124.3°
C4N21H26112.0°120.0°
C18C17C16111.1°109.5°
C18C17H18109.1°109.5°
C18C17H19109.1°109.4°
C17C18H20108.8°109.5°
C17C18H21108.8°109.5°
N5C25H31109.5°109.4°
N5C25H32109.5°109.5°
N5C25H33109.5°109.4°
C17C16H16108.6°109.5°
C17C16H17108.6°109.5°
C16C17H18109.0°109.5°
C16C17H19109.0°109.4°
H1C7H2109.5°109.5°
H4C9H5109.5°109.4°
H7C11H8109.4°109.5°
H10C13H11109.5°109.4°
H12C14H13109.5°109.5°
H14C15H15109.5°109.5°
H16C16H17109.5°109.5°
H18C17H19109.5°109.5°
H20C18H21109.5°109.5°
H22C19H23109.5°109.5°
H24C20H25109.5°109.5°
H29C24H30109.5°109.5°
H31C25H32109.5°109.5°
H31C25H33109.4°109.5°
H32C25H33109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C29C30C31H36180.0°180.0°
C30C29C28H35180.0°180.0°
C29C30C31C320.7°0.1°
C30C29C28N27179.9°180.0°
C30C29C28C330.2°0.2°
C29C30C31H37179.3°180.0°
C31C30C29C280.9°0.0°
C30C31C32H37180.0°179.9°
C30C31C32C330.2°0.4°
C31C30C29H35179.1°180.0°
C30C31C32H38179.8°180.0°
C29C28N27C33179.7°179.8°
C29C28N27C23179.7°147.1°
C29C28C33C320.6°0.6°
C29C28N27H340.3°32.8°
C28C29C30H36179.1°180.0°
C29C28C33H39179.4°179.8°
C31C32C33C280.8°0.6°
C31C32C33H38180.0°179.6°
C32C31C30H36179.3°179.9°
C31C32C33H39179.2°179.7°
C28N27C23H34180.0°180.0°
N27C28C33C32179.0°179.7°
C28N27C23N22172.2°174.6°
C28N27C23O266.4°5.3°
N27C28C29H350.1°0.0°
N27C28C33H391.0°0.0°
C33C28N27C230.6°32.6°
C28C33C32H39180.0°179.7°
C33C28N27H34179.4°147.4°
C33C28C29H35179.8°179.7°
C28C33C32H38179.1°179.7°
N27C23N22O26178.7°179.9°
N27C23N22C12172.4°180.0°
N27C23N22H287.6°0.1°
C33C32C31H37179.8°179.7°
C23N22C12H28180.0°179.9°
C23N22C12C13128.4°85.1°
C23N22C12C11105.6°155.0°
C23N22C12H912.1°34.9°
N22C23N27H347.8°5.4°
C12N22C23O268.9°0.1°
N22C12C13C11125.9°120.0°
N22C12C13H9116.9°120.0°
N22C12C13C14177.4°180.0°
N22C12C11H9118.3°120.1°
N22C12C11C8176.5°180.0°
N22C12C11H763.1°60.0°
N22C12C11H856.2°60.0°
N22C12C13H1057.1°60.0°
N22C12C13H1162.3°60.0°
O26C23N22H28171.0°180.0°
O26C23N27H34173.6°174.6°
C12C13C14H10120.3°120.0°
C12C13C14H11120.3°120.0°
C13C12C11H9117.2°120.0°
C13C12C11C852.1°60.0°
C12C13C14C1554.6°60.0°
C13C12C11H7172.4°60.0°
C13C12C11H868.3°180.0°
C12C13H10H11119.0°120.0°
C12C13C14H12174.9°180.0°
C12C13C14H1365.8°60.0°
C13C12N22H2851.6°95.0°
C14C13C12C1151.4°60.0°
C13C14C15H12120.3°120.0°
C13C14C15H13120.3°120.0°
C13C14C15C857.8°60.0°
C14C13C12H965.8°60.0°
C14C13H10H11119.1°120.0°
C13C14H12H13118.9°119.9°
C13C14C15H1462.3°180.0°
C13C14C15H15177.8°60.0°
C12C11C8H7120.4°120.0°
C12C11C8H8120.4°120.0°
C12C11C8C1555.2°60.0°
C12C11C8C24178.7°NaN°
C12C11C8H362.9°60.0°
C12C11H7H8118.9°120.0°
C11C12C13H1068.9°60.0°
C11C12C13H11171.7°180.0°
C11C12N22H2874.4°24.9°
C11C8C15C1457.8°60.0°
C11C8C15C24123.9°120.0°
C11C8C15H3118.1°120.0°
C11C8C24H3118.4°120.0°
C11C8C24C2149.3°170.2°
C8C11H7H8118.9°120.1°
C8C11C12H965.1°60.0°
C11C8C15H1462.3°180.0°
C11C8C15H15177.8°60.0°
C11C8C24H2928.3°69.8°
C11C8C24H3089.6°50.2°
C14C15C8H14120.1°120.0°
C14C15C8H15120.1°120.0°
C14C15C8C24178.4°180.0°
C14C15C8H360.4°60.0°
C15C14C13H1065.7°60.0°
C15C14C13H11174.9°180.0°
C15C14H12H13119.0°120.1°
C14C15H14H15119.8°120.0°
C15C8C24H3118.0°120.0°
C15C8C24C287.0°69.8°
C15C8C11H7175.6°59.9°
C15C8C11H865.1°180.0°
C8C15C14H12178.1°180.0°
C8C15C14H1362.5°60.0°
C8C15H14H15119.8°120.0°
C15C8C24H29152.0°50.3°
C15C8C24H3034.1°170.3°
C8C24C2H29121.0°120.0°
C8C24C2H30121.0°120.0°
C8C24C2C7177.2°172.9°
C8C24C2N355.0°64.6°
C8C24C2C159.7°50.3°
C24C8C11H760.9°60.0°
C24C8C11H858.4°60.0°
C24C8C15H1461.6°60.0°
C24C8C15H1558.3°60.0°
C8C24H29H30116.7°120.0°
C24C2C7N3124.6°122.5°
C24C2C7C1124.0°122.6°
C24C2C7C9175.0°178.2°
C24C2N3C1120.8°118.8°
C24C2N3C4120.7°118.7°
C24C2C1O660.7°61.0°
C24C2C1N5121.5°118.7°
C24C2C7H154.2°58.2°
C24C2C7H264.2°61.8°
C2C24C8H331.0°50.2°
C2C24H29H30116.8°120.0°
C24C2N3H4059.3°61.3°
C2C7C9H1120.9°120.0°
C2C7C9H2120.8°120.0°
C7C2N3C1117.2°118.7°
C7C2N3C4117.3°118.8°
C7C2C1O661.4°61.6°
C7C2C1N5116.3°118.8°
C2C7C9C10167.9°180.0°
C2C7H1H2117.4°120.1°
C2C7C9H447.1°60.0°
C2C7C9H571.3°60.0°
C7C2C24H2961.8°67.1°
C7C2C24H3056.2°52.9°
C7C2N3H4062.7°61.2°
C9C7C2N360.4°59.3°
C9C7C2C151.0°55.6°
C7C9C10C2066.2°65.0°
C7C9C10H4120.8°120.1°
C7C9C10H5120.8°120.0°
C7C9C10C16171.5°175.0°
C9C7H1H2117.4°120.0°
C7C9H4H5117.6°120.0°
C7C9C10H654.0°55.0°
C2N3C4H40180.0°180.0°
N3C2C1O6177.7°179.7°
N3C2C1N50.1°0.0°
C2N3C4N50.1°0.0°
C2N3C4N21179.2°180.0°
N3C2C7H1178.7°179.3°
N3C2C7H260.4°60.7°
N3C2C24H29176.0°55.4°
N3C2C24H3066.0°175.4°
C1C2N3C40.1°0.0°
C2C1O6N5177.3°179.6°
C2C1N5C40.0°0.0°
C2C1N5C25178.3°180.0°
C1C2C7H169.8°64.3°
C1C2C7H2171.8°175.6°
C1C2C24H2961.3°170.4°
C1C2C24H30179.2°69.7°
C1C2N3H40179.9°179.9°
C19C20C10H24120.2°120.0°
C19C20C10H25120.2°120.0°
C20C19C18H22120.5°119.9°
C20C19C18H23120.5°120.0°
C19C20C10C9177.8°180.0°
C19C20C10C1656.0°60.0°
C20C19C18C1751.8°60.0°
C19C20C10H662.1°60.0°
C20C19C18H2068.6°180.0°
C20C19C18H21172.3°60.1°
C20C19H22H23118.3°120.0°
C19C20H24H25119.4°120.0°
C10C20C19C1854.5°59.9°
C20C10C9C16122.3°120.1°
C20C10C9H6120.2°120.0°
C20C10C16H6118.1°120.0°
C20C10C16C1757.2°60.0°
C20C10C9H4173.0°175.0°
C20C10C9H554.6°55.0°
C20C10C16H16177.7°180.0°
C20C10C16H1763.4°60.0°
C10C20C19H22175.0°60.0°
C10C20C19H2366.1°180.0°
C10C20H24H25119.4°120.0°
C19C18C17H20120.4°120.0°
C19C18C17H21120.4°120.0°
C19C18C17C1650.7°60.0°
C19C18C17H18170.9°60.0°
C19C18C17H1969.5°180.0°
C19C18H20H21118.7°119.9°
C18C19H22H23118.4°120.0°
C18C19C20H24174.7°60.0°
C18C19C20H2565.7°180.0°
N3C4N5C10.0°0.0°
N3C4N5N21179.3°180.0°
N3C4N5C25178.3°180.0°
N3C4N21H26179.2°179.9°
O6C1N5C4177.7°179.7°
O6C1N5C254.0°0.3°
C1N5C4C25178.3°180.0°
C1N5C4N21179.3°179.9°
C1N5C25H31180.0°89.9°
C1N5C25H3260.0°150.0°
C1N5C25H3360.0°30.0°
C9C10C16H6117.4°119.9°
C9C10C16C17178.3°180.0°
C10C9C7H171.3°60.0°
C10C9C7H247.0°60.0°
C10C9H4H5117.6°119.9°
C9C10C16H1657.8°60.0°
C9C10C16H1761.2°60.1°
C9C10C20H2462.0°60.0°
C9C10C20H2557.6°59.9°
C10C16C17C1854.6°60.0°
C10C16C17H16120.5°120.0°
C10C16C17H17120.5°119.9°
C16C10C9H450.8°54.9°
C16C10C9H567.7°65.0°
C10C16H16H17118.4°120.0°
C10C16C17H18174.8°60.1°
C10C16C17H1965.7°180.0°
C16C10C20H24176.2°60.0°
C16C10C20H2564.2°180.0°
N5C4N21H260.0°0.0°
C4N5C25H311.9°90.0°
C4N5C25H32118.1°30.0°
C4N5C25H33121.9°150.0°
N5C4N3H40179.9°180.0°
N21C4N5C251.0°0.0°
N21C4N3H400.8°0.0°
C18C17C16H18120.2°120.1°
C18C17C16H19120.2°119.9°
C18C17C16H16175.1°180.0°
C18C17C16H1766.0°59.9°
C18C17H18H19119.3°120.0°
C17C18H20H21118.7°120.1°
C17C18C19H22172.4°59.9°
C17C18C19H2368.7°180.0°
N5C25H31H32120.0°120.0°
N5C25H31H33120.0°119.9°
N5C25H32H33120.0°120.0°
C17C16C10H660.9°60.0°
C17C16H16H17118.4°120.0°
C16C17H18H19119.2°120.0°
C16C17C18H2069.7°180.0°
C16C17C18H21171.1°59.9°
H1C7C9H4168.0°180.0°
H1C7C9H549.5°60.0°
H2C7C9H473.7°60.0°
H2C7C9H5167.8°180.0°
H3C8C11H757.5°180.0°
H3C8C11H8176.8°60.0°
H3C8C15H14179.6°60.0°
H3C8C15H1559.7°180.0°
H3C8C24H2990.1°170.2°
H3C8C24H30152.0°69.8°
H4C9C10H666.7°65.0°
H5C9C10H6174.8°175.0°
H6C10C16H1659.6°59.9°
H6C10C16H17178.6°180.0°
H6C10C20H2458.1°180.0°
H6C10C20H25177.7°60.0°
H7C11C12H955.2°180.0°
H8C11C12H9174.5°60.0°
H9C12C13H10173.9°180.0°
H9C12C13H1154.6°60.0°
H9C12N22H28167.9°145.0°
H10C13C14H1254.6°60.0°
H10C13C14H13174.0°179.9°
H11C13C14H1264.8°60.0°
H11C13C14H1354.5°60.0°
H12C14C15H1458.0°60.0°
H12C14C15H1561.9°60.0°
H13C14C15H14177.4°60.0°
H13C14C15H1557.5°180.0°
H16C16C17H1864.7°59.9°
H16C16C17H1954.8°60.0°
H17C16C17H1854.3°180.0°
H17C16C17H19173.8°60.0°
H18C17C18H2050.5°59.9°
H18C17C18H2168.7°180.0°
H19C17C18H20170.0°60.1°
H19C17C18H2150.9°60.0°
H20C18C19H2252.0°60.1°
H20C18C19H23170.9°60.0°
H21C18C19H2267.2°180.0°
H21C18C19H2351.8°60.0°
H22C19C20H2464.8°179.9°
H22C19C20H2554.8°60.0°
H23C19C20H2454.2°60.0°
H23C19C20H25173.8°60.0°
H31C25H32H33119.9°120.0°
H35C29C30H360.9°0.0°
H36C30C31H370.7°0.1°
H37C31C32H380.2°0.1°
H38C32C33H390.8°0.1°

222624

PDB entries from 2024-07-17

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