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A1D9C

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O1C2sing1.43Å1.44Å
C2C3sing1.54Å1.55Å
C3C4sing1.54Å1.51Å
C4N5sing1.47Å1.46Å
N5C6sing1.36Å1.37ÅAromatic
C6N7doub1.30Å1.31ÅAromatic
N7C8sing1.36Å1.38ÅAromatic
C8C9doub1.40Å1.40ÅAromatic
C9N10sing1.33Å1.35ÅAromatic
N10C11doub1.32Å1.32ÅAromatic
C11CL12sing1.74Å1.72Å
C11N13sing1.32Å1.33ÅAromatic
N13C14doub1.33Å1.33ÅAromatic
C9N15sing1.38Å1.34Å
C4O16sing1.44Å1.41Å
C3O17sing1.43Å1.41Å
C2C18sing1.55Å1.53Å
C18C19sing1.53Å1.52Å
C19S20sing1.81Å1.81Å
S20C21sing1.81Å1.79Å
C21C22sing1.53Å1.50Å
C22N23sing1.47Å1.49Å
N23C24sing1.47Å1.49Å
C24C25sing1.51Å1.52Å
C25O26sing1.34Å1.26Å
C25O27doub1.21Å1.25Å
C24C28sing1.53Å1.53Å
C28C29sing1.51Å1.49Å
C29C30doub1.35Å1.36ÅAromatic
C30N31sing1.37Å1.37ÅAromatic
N31C32sing1.35Å1.33ÅAromatic
C32N33doub1.31Å1.33ÅAromatic
C14N5sing1.37Å1.37ÅAromatic
C14C8sing1.41Å1.38ÅAromatic
C18O16sing1.44Å1.44Å
N33C29sing1.34Å1.38ÅAromatic
C4H4sing1.09Å1.10Å
C6H6sing1.08Å1.08Å
C21H21Asing1.09Å1.10Å
C21H21Bsing1.09Å1.10Å
C22H22Bsing1.09Å1.10Å
C22H22Asing1.09Å1.10Å
C24H24sing1.09Å1.10Å
C28H28Asing1.09Å1.10Å
C28H28Bsing1.09Å1.10Å
O1H1sing0.97Å0.95Å
C2H2sing1.09Å1.10Å
C3H3sing1.09Å1.10Å
N15H15Asing0.97Å1.00Å
N15H15Bsing0.97Å1.00Å
O17H17sing0.97Å0.95Å
C18H18sing1.09Å1.10Å
C19H19Bsing1.09Å1.10Å
C19H19Asing1.09Å1.10Å
N23H23sing1.01Å1.00Å
O26H5sing0.97Å0.95Å
C30H30sing1.08Å1.08Å
N31H31sing0.97Å1.00Å
C32H32sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1C2C3114.3°110.5°
O1C2C18109.8°110.5°
C2O1H1109.5°114.0°
O1C2H2110.6°110.5°
C2C3C4102.3°104.1°
C2C3O17111.6°110.5°
C3C2C18103.5°104.1°
C3C2H2109.1°110.5°
C2C3H3110.8°110.5°
C3C4N5114.9°110.4°
C3C4O16106.0°104.8°
C4C3O17107.4°110.5°
C3C4H4108.3°110.5°
C4C3H3111.3°110.5°
C4N5C6128.7°126.3°
N5C4O16109.1°110.4°
C4N5C14125.6°126.3°
N5C4H4108.9°110.3°
N5C6N7114.0°110.0°
C6N5C14105.7°107.4°
N5C6H6123.0°125.0°
C6N7C8103.7°109.4°
N7C6H6123.0°125.0°
N7C8C9132.6°134.7°
N7C8C14110.8°107.1°
C8C9N10118.6°118.5°
C8C9N15123.8°120.8°
C9C8C14116.5°118.2°
C9N10C11117.1°121.2°
N10C9N15117.6°120.7°
N10C11CL12114.4°118.8°
N10C11N13130.8°122.4°
CL12C11N13114.7°118.8°
C11N13C14110.3°120.6°
N13C14N5127.5°134.9°
N13C14C8126.6°119.1°
C9N15H15A109.5°120.0°
C9N15H15B109.5°120.0°
C4O16C18107.0°105.3°
O16C4H4109.6°110.4°
O17C3H3112.9°110.6°
C3O17H17109.5°114.0°
C2C18C19110.0°110.4°
C2C18O16107.9°104.8°
C18C2H2109.3°110.6°
C2C18H18108.7°110.3°
C18C19S20105.9°109.5°
C19C18O16111.4°110.4°
C19C18H18108.9°110.3°
C18C19H19B110.4°109.4°
C18C19H19A110.4°109.5°
C19S20C21101.0°103.0°
S20C19H19B110.4°109.5°
S20C19H19A110.4°109.5°
S20C21C22111.9°109.4°
S20C21H21A108.9°109.4°
S20C21H21B108.8°109.5°
C21C22N23108.8°109.4°
C22C21H21A108.8°109.5°
C22C21H21B108.9°109.5°
C21C22H22B109.7°109.5°
C21C22H22A109.6°109.5°
C22N23C24117.4°111.0°
N23C22H22B109.6°109.5°
N23C22H22A109.6°109.5°
C22N23H23107.5°111.0°
N23C24C25108.0°109.4°
N23C24C28109.6°109.5°
N23C24H24109.5°109.5°
C24N23H23107.4°110.9°
C24C25O26116.6°120.0°
C24C25O27116.5°120.0°
C25C24C28111.6°109.5°
C25C24H24109.1°109.5°
O26C25O27126.7°120.0°
C25O26H5109.5°117.0°
C24C28C29112.1°109.5°
C28C24H24109.0°109.5°
C24C28H28A108.8°109.5°
C24C28H28B108.8°109.5°
C28C29C30129.8°126.0°
C28C29N33120.9°125.9°
C29C28H28A108.8°109.4°
C29C28H28B108.8°109.5°
C29C30N31106.6°106.8°
C30C29N33109.2°108.1°
C29C30H30126.7°126.6°
C30N31C32107.1°107.2°
N31C30H30126.7°126.6°
C30N31H31126.5°126.4°
N31C32N33111.8°108.7°
C32N31H31126.4°126.4°
N31C32H32124.1°125.6°
C32N33C29105.3°109.3°
N33C32H32124.1°125.7°
N5C14C8105.9°106.0°
O16C18H18109.9°110.5°
H21AC21H21B109.5°109.5°
H22BC22H22A109.5°109.5°
H28AC28H28B109.5°109.5°
H15AN15H15B109.5°120.0°
H19BC19H19A109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1C2C3C18119.3°118.6°
O1C2C3H2124.3°122.6°
O1C2C3C497.5°118.6°
O1C2C3O1717.1°0.0°
O1C2C18H2121.5°122.6°
O1C2C18C19117.8°98.5°
O1C2C18O16120.5°142.6°
O1C2C3H3143.8°122.7°
O1C2C18H181.4°23.7°
C2C3C4O17117.6°118.7°
C2C3C4H3118.3°118.6°
C2C3C4N5156.1°142.8°
C2C3C4O1635.6°24.0°
C2C3O17H3125.5°122.7°
C3C2C18H2116.1°118.7°
C3C2C18C19119.8°142.8°
C3C2C18O161.8°24.0°
C2C3C4H481.9°94.9°
C3C2O1H1180.0°61.4°
C2C3O17H17180.0°61.4°
C3C2C18H18121.0°94.9°
C3C4N5O16118.8°115.4°
C3C4N5H4121.6°122.4°
C3C4N5C631.9°91.8°
C3C4O16H4116.6°119.0°
C4C3O17H3123.1°122.7°
C4C3C2C1821.9°0.0°
C3C4N5C14148.1°88.1°
C3C4O16C1835.7°40.5°
C4C3C2H2138.2°118.7°
C4C3O17H1768.6°176.1°
C4N5C6C14180.0°179.9°
C4N5C6N7180.0°179.9°
C4N5C14N131.9°0.0°
N5C4O16H4119.1°122.2°
N5C4C3O1786.3°98.5°
C4N5C14C8179.8°179.7°
N5C4O16C18160.0°159.4°
C4N5C6H60.1°0.3°
N5C4C3H337.8°24.2°
N5C6N7H6180.0°179.7°
N5C6N7C80.2°0.2°
C6N5C14N13178.1°179.9°
C6N5C4O1687.0°23.6°
C6N5C14C80.1°0.2°
C6N5C4H4153.5°145.8°
C6N7C8C9177.1°180.0°
N7C6N5C140.1°0.0°
C6N7C8C140.3°0.4°
N7C8C9C14177.3°179.6°
N7C8C9N10177.7°179.9°
N7C8C14N13178.3°179.9°
N7C8C9N152.9°0.0°
N7C8C14N50.3°0.4°
C8N7C6H6179.8°180.0°
C8C9N10N15179.5°179.9°
C8C9N10C110.5°0.0°
C9C8C14N130.4°0.2°
C9C8C14N5177.6°179.9°
C8C9N15H15A179.5°0.0°
C8C9N15H15B59.5°180.0°
C9N10C11CL12179.9°180.0°
C9N10C11N130.8°0.8°
N10C9C8C140.3°0.5°
N10C9N15H15A0.0°180.0°
N10C9N15H15B120.0°0.1°
N10C11CL12N13179.4°179.2°
N10C11N13C140.8°1.2°
C11N10C9N15180.0°180.0°
CL12C11N13C14179.9°179.7°
C11N13C14N5177.1°179.0°
C11N13C14C80.5°0.7°
N13C14N5C8178.0°179.7°
N15C9C8C14179.8°179.6°
C9N15H15AH15B120.0°180.0°
O16C4C3O17153.2°142.6°
C4O16C18C220.8°40.5°
C4O16C18C19141.6°159.3°
O16C4N5C1493.1°156.4°
O16C4C3H382.8°94.7°
C4O16C18H1897.6°78.3°
O17C3C2C18136.5°118.7°
O17C3C4H435.8°23.8°
O17C3C2H2107.2°122.6°
C2C18C19O16119.6°115.4°
C2C18C19H18119.0°122.2°
C2C18C19S2065.7°175.0°
C2C18O16H18118.4°118.8°
C18C2O1H164.2°176.1°
C18C2C3H396.9°118.6°
C2C18C19H19B53.7°55.0°
C2C18C19H19A174.9°65.0°
C18C19S20H19B119.4°119.9°
C18C19S20H19A119.4°120.0°
C18C19S20C21176.9°180.0°
C19C18O16H18120.8°122.3°
C19C18C2H23.7°24.1°
C18C19H19BH19A121.7°120.0°
C19S20C21C2287.8°180.0°
S20C19C18O16174.7°69.6°
C19S20C21H21A151.8°60.0°
C19S20C21H21B32.5°60.0°
S20C19C18H1853.3°52.7°
S20C19H19BH19A121.7°120.1°
S20C21C22H21A120.4°120.0°
S20C21C22H21B120.4°120.0°
S20C21C22N23177.0°180.0°
S20C21H21AH21B118.9°120.0°
S20C21C22H22B57.1°60.0°
S20C21C22H22A63.1°60.0°
C21S20C19H19B63.7°60.0°
C21S20C19H19A57.4°60.0°
C21C22N23H22B119.9°120.0°
C21C22N23H22A119.9°120.0°
C21C22N23C24154.9°180.0°
C22C21H21AH21B118.9°120.0°
C21C22H22BH22A120.3°120.1°
C21C22N23H2384.0°56.1°
C22N23C24H23121.1°123.9°
C22N23C24C2571.9°85.0°
C22N23C24C28166.3°155.0°
N23C22C21H21A62.6°60.0°
N23C22C21H21B56.6°60.0°
N23C22H22BH22A120.3°120.0°
C22N23C24H2446.8°35.0°
N23C24C25C28120.6°120.0°
N23C24C25H24118.9°120.0°
N23C24C25O26167.5°180.0°
N23C24C25O2716.7°0.0°
N23C24C28H24119.8°120.0°
N23C24C28C2961.0°65.0°
C24N23C22H22B35.0°60.0°
C24N23C22H22A85.3°60.0°
N23C24C28H28A178.6°55.0°
N23C24C28H28B59.4°175.0°
C24C25O26O27175.3°179.9°
C25C24C28H24120.5°120.0°
C25C24C28C2958.7°175.0°
C25C24C28H28A61.8°65.0°
C25C24C28H28B179.0°55.0°
C25C24N23H23166.9°151.1°
C24C25O26H5175.3°180.0°
O26C25C24C2871.9°60.0°
O26C25C24H2448.6°60.0°
O27C25C24C28103.9°120.0°
O27C25C24H24135.6°120.0°
O27C25O26H50.0°0.0°
C24C28C29H28A120.4°120.0°
C24C28C29H28B120.4°120.1°
C24C28C29C30101.3°125.0°
C24C28C29N3380.9°55.3°
C24C28H28AH28B118.8°120.0°
C28C24N23H2345.1°31.1°
C28C29C30N33177.9°179.8°
C28C29C30N31177.8°180.0°
C28C29N33C32178.0°179.8°
C29C28C24H24179.2°55.0°
C29C28H28AH28B118.8°119.9°
C28C29C30H302.2°0.1°
C29C30N31H30180.0°179.9°
C29C30N31C320.1°0.0°
C30C29N33C320.2°0.4°
C30C29C28H28A19.1°5.0°
C30C29C28H28B138.3°115.0°
C29C30N31H31180.0°180.0°
C30N31C32H31180.0°180.0°
C30N31C32N330.1°0.3°
N31C30C29N330.1°0.2°
C30N31C32H32180.0°180.0°
N31C32N33H32180.0°179.7°
N31C32N33C290.1°0.4°
C32N31C30H30179.9°179.9°
N33C32N31H31179.9°179.8°
C14N5C4H426.4°34.3°
C14N5C6H6179.9°179.7°
C18O16C4H480.9°78.5°
O16C18C2H2118.0°94.8°
O16C18C19H19B65.9°170.4°
O16C18C19H19A55.3°50.4°
N33C29C28H28A158.7°175.3°
N33C29C28H28B39.4°64.8°
N33C29C30H30179.9°179.8°
C29N33C32H32179.9°179.9°
H4C4C3H3159.8°146.4°
H21AC21C22H22B177.5°59.9°
H21AC21C22H22A57.2°180.0°
H21BC21C22H22B63.3°180.0°
H21BC21C22H22A176.5°60.0°
H22BC22N23H23156.1°176.1°
H22AC22N23H2335.8°63.9°
H24C24C28H28A58.8°175.0°
H24C24C28H28B60.4°65.0°
H24C24N23H2374.4°89.0°
H1O1C2H256.5°61.2°
H2C2C3H319.5°0.1°
H2C2C18H18122.9°146.3°
H3C3O17H1754.5°61.3°
H18C18C19H19B172.8°67.3°
H18C18C19H19A66.1°172.8°
H30C30N31H310.0°0.0°
H31N31C32H320.0°0.1°

250835

PDB entries from 2026-03-18

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