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KSK

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N1C2sing1.37Å1.34ÅAromatic
N1C6sing1.37Å1.34ÅAromatic
N1N9sing1.40Å1.42ÅAromatic
C2C3doub1.38Å1.40ÅAromatic
C2N26sing1.38Å1.35Å
C3C4sing1.39Å1.40ÅAromatic
C4N5doub1.32Å1.35ÅAromatic
C4C24sing1.51Å1.48Å
N5C6sing1.33Å1.35ÅAromatic
C6C7doub1.41Å1.47ÅAromatic
C7C8sing1.41Å1.48ÅAromatic
C7C10sing1.46Å1.49Å
C8N9doub1.31Å1.36ÅAromatic
C8N13sing1.39Å1.35Å
C10O11doub1.22Å1.22Å
C10N12sing1.35Å1.33Å
N13C14sing1.40Å1.35Å
C14C15doub1.39Å1.39ÅAromatic
C14C19sing1.39Å1.39ÅAromatic
C15C16sing1.39Å1.39ÅAromatic
C16C17doub1.39Å1.39ÅAromatic
C16O22sing1.36Å1.37Å
C17C18sing1.39Å1.39ÅAromatic
C18C19doub1.39Å1.39ÅAromatic
C18O20sing1.36Å1.38Å
O20C21sing1.43Å1.43Å
O22C23sing1.43Å1.43Å
C24C25sing1.53Å1.52Å
C24C30sing1.53Å1.53Å
C25C30sing1.53Å1.52Å
N26C27sing1.47Å1.45Å
C27C28sing1.53Å1.54Å
C28N29sing1.47Å1.46Å
C28C31sing1.53Å1.53Å
C28C32sing1.53Å1.53Å
C3H3sing1.08Å1.08Å
N12HN12sing0.97Å1.00Å
N12HN1Asing0.97Å1.00Å
N13HN13sing0.97Å1.00Å
C15H15sing1.08Å1.08Å
C17H17sing1.08Å1.08Å
C19H19sing1.08Å1.08Å
C21H21sing1.09Å1.10Å
C21H21Asing1.09Å1.10Å
C21H21Bsing1.09Å1.10Å
C23H23sing1.09Å1.10Å
C23H23Asing1.09Å1.10Å
C23H23Bsing1.09Å1.10Å
C24H24sing1.09Å1.10Å
C25H25sing1.09Å1.10Å
C25H25Asing1.09Å1.10Å
N26HN26sing0.97Å1.00Å
C27H27sing1.09Å1.10Å
C27H27Asing1.09Å1.10Å
N29HN29sing1.01Å1.00Å
N29HN2Asing1.01Å1.00Å
C30H30sing1.09Å1.10Å
C30H30Asing1.09Å1.10Å
C31H31sing1.09Å1.10Å
C31H31Asing1.09Å1.10Å
C31H31Bsing1.09Å1.10Å
C32H32sing1.09Å1.10Å
C32H32Asing1.09Å1.10Å
C32H32Bsing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2N1C6118.4°119.6°
C2N1N9124.4°132.0°
N1C2C3118.5°118.8°
N1C2N26120.8°120.6°
C6N1N9117.3°108.4°
N1C6N5126.1°121.0°
N1C6C7103.8°106.8°
N1N9C8102.4°109.5°
C3C2N26120.7°120.6°
C2C3C4121.0°119.1°
C2C3H3119.5°120.4°
C2N26C27120.8°120.0°
C2N26HN26105.9°120.0°
C3C4N5119.0°120.3°
C3C4C24120.4°119.9°
C4C3H3119.5°120.5°
N5C4C24120.6°119.9°
C4N5C6117.0°121.2°
C4C24C25110.1°117.5°
C4C24C30110.6°117.5°
C4C24H24100.8°115.6°
N5C6C7130.2°132.3°
C6C7C8104.8°106.9°
C6C7C10124.7°126.6°
C8C7C10130.5°126.5°
C7C8N9111.8°108.5°
C7C8N13120.8°125.7°
C7C10O11117.5°120.0°
C7C10N12120.1°120.0°
N9C8N13127.4°125.8°
C8N13C14126.3°120.0°
C8N13HN13116.8°120.0°
O11C10N12122.5°120.0°
C10N12HN12120.0°120.0°
C10N12HN1A120.0°120.0°
N13C14C15122.7°120.0°
N13C14C19117.3°120.0°
C14N13HN13116.9°120.0°
C15C14C19120.0°119.9°
C14C15C16119.6°120.0°
C14C15H15120.2°120.0°
C14C19C18120.7°120.0°
C14C19H19119.6°120.0°
C15C16C17120.1°120.0°
C15C16O22119.9°120.0°
C16C15H15120.2°120.0°
C17C16O22120.0°120.0°
C16C17C18120.0°120.0°
C16C17H17120.0°120.0°
C16O22C23120.0°117.0°
C17C18C19119.5°120.0°
C17C18O20121.7°120.0°
C18C17H17120.0°120.0°
C19C18O20118.8°120.0°
C18C19H19119.7°120.0°
C18O20C21120.9°117.0°
O20C21H21109.5°109.4°
O20C21H21A109.5°109.5°
O20C21H21B109.4°109.5°
O22C23H23109.5°109.4°
O22C23H23A109.4°109.5°
O22C23H23B109.4°109.4°
C25C24C3059.9°60.0°
C24C25C3060.1°60.0°
C25C24H24135.8°117.4°
C24C25H25130.8°117.5°
C24C25H25A130.8°117.5°
C24C30C2560.0°60.0°
C30C24H24135.3°117.5°
C24C30H30130.9°117.5°
C24C30H30A130.9°117.5°
C30C25H25130.8°117.5°
C30C25H25A130.8°117.5°
C25C30H30130.9°117.5°
C25C30H30A130.9°117.5°
N26C27C28112.9°109.4°
C27N26HN26105.8°120.0°
N26C27H27108.3°109.4°
N26C27H27A108.4°109.5°
C27C28N29107.9°109.5°
C27C28C31111.6°109.5°
C27C28C32111.7°109.4°
C28C27H27108.3°109.5°
C28C27H27A108.4°109.5°
N29C28C31108.4°109.5°
N29C28C32107.6°109.5°
C28N29HN29109.5°111.0°
C28N29HN2A109.5°111.0°
C31C28C32109.6°109.5°
C28C31H31109.5°109.5°
C28C31H31A109.5°109.5°
C28C31H31B109.5°109.5°
C28C32H32109.5°109.5°
C28C32H32A109.4°109.4°
C28C32H32B109.4°109.5°
HN12N12HN1A120.0°120.0°
H21C21H21A109.5°109.5°
H21C21H21B109.5°109.5°
H21AC21H21B109.5°109.5°
H23C23H23A109.5°109.5°
H23C23H23B109.5°109.5°
H23AC23H23B109.5°109.5°
H25C25H25A81.9°115.5°
H27C27H27A110.6°109.5°
HN29N29HN2A109.5°111.0°
H30C30H30A81.8°115.5°
H31C31H31A109.4°109.5°
H31C31H31B109.5°109.5°
H31AC31H31B109.5°109.4°
H32C32H32A109.5°109.5°
H32C32H32B109.5°109.5°
H32AC32H32B109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2N1C6N9179.8°179.8°
N1C2C3N26179.8°179.9°
N1C2C3C40.1°0.1°
C2N1C6N50.1°0.1°
C2N1C6C7179.8°179.9°
C2N1N9C8179.4°179.8°
N1C2N26C27151.8°180.0°
N1C2C3H3179.9°180.0°
N1C2N26HN2688.2°0.1°
C6N1C2C30.1°0.1°
C6N1C2N26179.6°180.0°
N1C6N5C40.0°0.0°
N1C6N5C7179.9°180.0°
N1C6C7C80.4°0.0°
N1C6C7C10179.3°180.0°
C6N1N9C80.3°0.4°
N9N1C2C3179.9°179.7°
N9N1C2N260.1°0.2°
N9N1C6N5179.9°179.8°
N9N1C6C70.1°0.2°
N1N9C8C70.6°0.4°
N1N9C8N13179.2°179.9°
C2C3C4H3180.0°179.9°
C2C3C4N50.0°0.1°
C2C3C4C24179.9°180.0°
C3C2N26C2728.0°0.1°
C3C2N26HN2692.0°180.0°
N26C2C3C4179.7°180.0°
C2N26C27HN26120.0°179.9°
C2N26C27C2882.4°179.9°
N26C2C3H30.3°0.1°
C2N26C27H2737.5°60.1°
C2N26C27H27A157.5°59.9°
C3C4N5C24179.9°180.0°
C3C4N5C60.0°0.0°
C3C4C24C25111.9°175.0°
C3C4C24C30176.3°116.4°
C3C4C24H2436.0°29.4°
C4N5C6C7179.9°180.0°
N5C4C24C2568.1°5.0°
N5C4C24C303.8°63.6°
N5C4C3H3180.0°180.0°
N5C4C24H24144.0°150.6°
C24C4N5C6180.0°180.0°
C4C24C25C30102.8°107.5°
C4C24C25H24131.6°145.0°
C4C24C30H24131.8°145.1°
C24C4C3H30.1°0.0°
C4C24C25H2517.2°0.0°
C4C24C25H25A137.2°145.0°
C4C24C30H30138.1°145.0°
C4C24C30H30A18.1°0.0°
N5C6C7C8179.5°180.0°
N5C6C7C100.7°0.0°
C6C7C8C10178.8°180.0°
C6C7C8N90.6°0.3°
C6C7C8N13179.4°180.0°
C6C7C10O11175.9°90.0°
C6C7C10N122.8°89.9°
C7C8N9N13178.6°179.7°
C8C7C10O112.6°90.1°
C8C7C10N12178.7°90.0°
C7C8N13C14168.8°174.3°
C7C8N13HN1311.1°5.7°
C10C7C8N9179.4°179.8°
C10C7C8N131.8°0.0°
C7C10O11N12178.7°179.9°
C7C10N12HN12178.7°0.1°
C7C10N12HN1A1.3°180.0°
N9C8N13C1412.6°5.3°
N9C8N13HN13167.4°174.7°
C8N13C14HN13180.0°180.0°
C8N13C14C1516.1°154.6°
C8N13C14C19164.5°25.7°
O11C10N12HN120.0°180.0°
O11C10N12HN1A180.0°0.1°
C10N12HN12HN1A180.0°179.9°
N13C14C15C19179.4°179.7°
N13C14C15C16179.7°180.0°
N13C14C19C18179.5°179.7°
N13C14C15H150.3°0.0°
N13C14C19H190.4°0.0°
C14C15C16H15180.0°180.0°
C14C15C16C170.5°0.0°
C14C15C16O22179.9°180.0°
C15C14C19C180.1°0.6°
C15C14N13HN13163.9°25.4°
C15C14C19H19179.9°179.7°
C19C14C15C160.3°0.3°
C14C19C18C170.1°0.6°
C14C19C18H19180.0°179.7°
C14C19C18O20179.8°179.7°
C19C14N13HN1315.5°154.3°
C19C14C15H15179.7°179.7°
C15C16C17O22179.6°179.9°
C15C16C17C180.5°0.0°
C15C16O22C2326.8°180.0°
C15C16C17H17179.5°180.0°
C16C17C18H17180.0°180.0°
C16C17C18C190.3°0.3°
C16C17C18O20180.0°180.0°
C17C16O22C23153.6°0.1°
C17C16C15H15179.5°180.0°
O22C16C17C18179.9°179.9°
O22C16C15H150.0°0.1°
O22C16C17H170.1°0.1°
C16O22C23H23180.0°180.0°
C16O22C23H23A60.0°60.0°
C16O22C23H23B60.0°60.1°
C17C18C19O20179.7°179.7°
C17C18O20C2117.9°0.0°
C17C18C19H19179.9°179.7°
C19C18O20C21162.3°179.7°
C19C18C17H17179.7°179.7°
O20C18C17H170.0°0.0°
O20C18C19H190.1°0.0°
C18O20C21H21180.0°60.0°
C18O20C21H21A60.0°180.0°
C18O20C21H21B60.0°60.0°
O20C21H21H21A120.0°120.0°
O20C21H21H21B120.0°119.9°
O20C21H21AH21B120.0°120.0°
O22C23H23H23A120.0°120.0°
O22C23H23H23B120.0°119.9°
O22C23H23AH23B120.0°120.0°
C25C24C30H24126.2°107.4°
C24C25C30H25120.0°107.5°
C24C25C30H25A120.0°107.5°
C24C25H25H25A138.6°145.7°
C25C24C30H30120.0°107.5°
C25C24C30H30A120.0°107.5°
C24C30H30H30A138.6°145.7°
C30C25H25H25A138.5°145.7°
C25C30H30H30A138.6°145.7°
N26C27C28H27120.0°119.9°
N26C27C28H27A120.0°120.0°
N26C27C28N29174.1°55.1°
N26C27C28C3166.9°65.0°
N26C27C28C3256.1°175.0°
N26C27H27H27A118.6°120.0°
C27C28N29C31121.0°120.0°
C27C28N29C32120.6°119.9°
C27C28C31C32124.2°119.9°
C28C27N26HN26157.5°0.1°
C28C27H27H27A118.6°120.0°
C27C28N29HN29180.0°176.0°
C27C28N29HN2A60.0°60.0°
C27C28C31H31180.0°60.0°
C27C28C31H31A60.0°180.0°
C27C28C31H31B60.0°60.1°
C27C28C32H32180.0°60.0°
C27C28C32H32A60.0°180.0°
C27C28C32H32B60.0°60.0°
N29C28C31C32117.1°120.1°
N29C28C27H2765.9°175.0°
N29C28C27H27A54.1°65.0°
C28N29HN29HN2A120.0°124.0°
N29C28C31H3161.4°180.0°
N29C28C31H31A178.7°60.0°
N29C28C31H31B58.6°60.0°
N29C28C32H3261.8°59.9°
N29C28C32H32A58.2°60.0°
N29C28C32H32B178.2°180.0°
C31C28C27H2753.0°55.0°
C31C28C27H27A173.0°175.0°
C31C28N29HN2959.0°56.0°
C31C28N29HN2A61.0°180.0°
C28C31H31H31A120.0°120.0°
C28C31H31H31B120.0°120.1°
C28C31H31AH31B120.0°120.0°
C31C28C32H3255.8°180.0°
C31C28C32H32A175.8°60.0°
C31C28C32H32B64.2°59.9°
C32C28C27H27176.1°65.0°
C32C28C27H27A63.9°55.0°
C32C28N29HN2959.4°64.0°
C32C28N29HN2A179.4°60.0°
C32C28C31H3155.8°60.0°
C32C28C31H31A64.2°60.0°
C32C28C31H31B175.8°180.0°
C28C32H32H32A120.0°120.0°
C28C32H32H32B120.0°120.0°
C28C32H32AH32B120.0°120.0°
H21C21H21AH21B120.0°120.0°
H23C23H23AH23B120.0°120.0°
H24C24C25H25114.4°145.0°
H24C24C25H25A5.6°0.0°
H24C24C30H306.3°0.1°
H24C24C30H30A113.7°145.1°
H25C25C30H30120.0°145.0°
H25C25C30H30A0.0°0.0°
H25AC25C30H300.0°0.0°
H25AC25C30H30A120.0°145.0°
HN26N26C27H2782.5°120.0°
HN26N26C27H27A37.5°120.0°
H31C31H31AH31B120.0°120.0°
H32C32H32AH32B120.0°120.0°

222624

PDB entries from 2024-07-17

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