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KRJ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N01C02trip1.14Å1.16Å
C02C03sing1.43Å1.43Å
C03N07sing1.34Å1.40ÅAromatic
C03C04doub1.38Å1.38ÅAromatic
H04C04sing1.08Å1.08Å
C04N05sing1.35Å1.38ÅAromatic
C06N05sing1.37Å1.33ÅAromatic
N05HN05sing0.97Å1.00Å
N07C06doub1.31Å1.33ÅAromatic
C06C08sing1.48Å1.49Å
N10C08sing1.35Å1.34Å
C08O09doub1.22Å1.23Å
HN10N10sing0.97Å1.00Å
N10C11sing1.40Å1.42Å
C16C11doub1.40Å1.43ÅAromatic
C11C12sing1.39Å1.41ÅAromatic
C12H12sing1.08Å1.08Å
C12C13doub1.38Å1.39ÅAromatic
C14C13sing1.38Å1.41ÅAromatic
C13H13sing1.08Å1.08Å
C15C14doub1.38Å1.42ÅAromatic
C14C23sing1.51Å1.54Å
C16C15sing1.40Å1.43ÅAromatic
H15C15sing1.08Å1.08Å
C17C16sing1.48Å1.49Å
C22C17sing1.50Å1.53Å
C18C17doub1.31Å1.35Å
C19C18sing1.50Å1.52Å
C18H18sing1.08Å1.08Å
C20C19sing1.53Å1.54Å
H19AC19sing1.09Å1.10Å
H19C19sing1.09Å1.10Å
H20AC20sing1.09Å1.10Å
C20H20sing1.09Å1.10Å
C20C21sing1.53Å1.53Å
H21AC21sing1.09Å1.10Å
H21C21sing1.09Å1.10Å
C21C22sing1.53Å1.54Å
C22H22Asing1.09Å1.10Å
C22H22sing1.09Å1.10Å
C28C23sing1.53Å1.56Å
C23C24sing1.53Å1.56Å
C23H23sing1.09Å1.10Å
H24C24sing1.09Å1.10Å
C24C25sing1.53Å1.54Å
C24H24Asing1.09Å1.10Å
H25AC25sing1.09Å1.10Å
C25H25sing1.09Å1.10Å
C25N26sing1.47Å1.46Å
C27N26sing1.47Å1.46Å
N26HN26sing1.01Å1.00Å
H27C27sing1.09Å1.10Å
C28C27sing1.53Å1.55Å
C27H27Asing1.09Å1.10Å
H28C28sing1.09Å1.10Å
C28H28Asing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N01C02C03179.4°180.0°
C02C03N07122.1°126.2°
C02C03C04128.8°126.2°
N07C03C04109.1°107.7°
C03N07C06105.1°109.1°
C03C04H04127.2°126.5°
C03C04N05105.6°106.8°
H04C04N05127.2°126.7°
C04N05C06108.1°107.5°
C04N05HN05125.9°126.1°
C06N05HN05126.0°126.3°
N05C06N07112.1°108.9°
N05C06C08119.3°125.5°
N07C06C08128.5°125.6°
C06C08N10113.5°120.0°
C06C08O09120.0°120.0°
N10C08O09126.5°120.0°
C08N10HN10115.8°120.0°
C08N10C11128.3°120.0°
HN10N10C11115.9°120.0°
N10C11C16122.1°120.2°
N10C11C12118.2°120.1°
C16C11C12119.6°119.7°
C11C16C15119.1°119.6°
C11C16C17121.1°120.2°
C11C12H12119.6°120.0°
C11C12C13120.7°120.0°
H12C12C13119.6°120.0°
C12C13C14121.6°120.4°
C12C13H13119.2°119.8°
C14C13H13119.2°119.8°
C13C14C15118.5°120.3°
C13C14C23113.9°119.9°
C15C14C23127.5°119.8°
C14C15C16120.5°119.9°
C14C15H15119.8°120.0°
C14C23C28118.0°109.5°
C14C23C24112.5°109.5°
C14C23H23102.6°109.5°
C16C15H15119.8°120.0°
C15C16C17119.8°120.2°
C16C17C22118.5°118.1°
C16C17C18120.7°118.1°
C22C17C18119.0°123.9°
C17C22C21114.8°110.0°
C17C22H22A107.8°109.1°
C17C22H22107.7°109.7°
C17C18C19125.0°123.9°
C17C18H18117.5°118.1°
C19C18H18117.5°118.1°
C18C19C20112.2°110.1°
C18C19H19A108.6°109.4°
C18C19H19108.6°109.4°
C20C19H19A108.6°109.3°
C20C19H19108.6°109.3°
C19C20H20A109.3°109.6°
C19C20H20109.3°109.6°
C19C20C21110.0°108.5°
H19AC19H19110.4°109.2°
H20AC20H20109.7°109.7°
H20AC20C21109.3°109.8°
H20C20C21109.3°109.6°
C20C21H21A108.6°109.6°
C20C21H21108.6°109.6°
C20C21C22112.0°108.4°
H21AC21H21110.3°109.8°
H21AC21C22108.7°109.6°
H21C21C22108.6°109.8°
C21C22H22A107.7°109.4°
C21C22H22107.8°109.4°
H22AC22H22111.1°109.3°
C28C23C24114.8°109.1°
C28C23H2399.4°109.6°
C23C28C27117.0°109.3°
C23C28H28107.0°109.6°
C23C28H28A107.0°109.6°
C24C23H23107.1°109.5°
C23C24H24107.6°109.5°
C23C24C25115.2°109.3°
C23C24H24A107.6°109.5°
H24C24C25107.6°109.5°
H24C24H24A111.3°109.5°
C25C24H24A107.6°109.5°
C24C25H25A110.2°109.5°
C24C25H25110.2°109.5°
C24C25N26107.4°109.5°
H25AC25H25108.8°109.5°
H25AC25N26110.2°109.4°
H25C25N26110.1°109.4°
C25N26C27105.1°111.2°
C25N26HN26111.0°111.0°
C27N26HN26111.0°111.0°
N26C27H27109.4°109.5°
N26C27C28109.6°109.5°
N26C27H27A109.5°109.5°
H27C27C28109.5°109.5°
H27C27H27A109.5°109.5°
C28C27H27A109.4°109.4°
C27C28H28107.1°109.5°
C27C28H28A107.0°109.4°
H28C28H28A111.8°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N01C02C03N0710.3°101.2°
N01C02C03C04169.3°79.1°
C02C03N07C04179.7°179.8°
C02C03C04H040.1°0.0°
C02C03C04N05179.9°180.0°
C02C03N07C06180.0°179.8°
N07C03C04H04179.8°179.8°
N07C03C04N050.2°0.2°
C03N07C06N050.4°0.4°
C03N07C06C08177.5°179.8°
C03C04H04N05180.0°180.0°
C03C04N05C060.0°0.0°
C03C04N05HN05180.0°180.0°
C04C03N07C060.3°0.4°
H04C04N05C06180.0°180.0°
H04C04N05HN050.0°0.1°
C04N05C06HN05180.0°179.9°
C04N05C06N070.2°0.2°
C04N05C06C08177.7°180.0°
N05C06N07C08177.2°179.8°
N05C06C08N10169.2°180.0°
N05C06C08O0910.0°0.0°
HN05N05C06N07179.8°179.8°
HN05N05C06C082.3°0.0°
N07C06C08N1013.8°0.2°
N07C06C08O09167.0°179.7°
C06C08N10O09179.1°180.0°
C06C08N10HN104.8°5.5°
C06C08N10C11175.2°174.5°
C08N10HN10C11180.0°180.0°
C08N10C11C16171.8°154.9°
C08N10C11C1211.4°24.8°
O09C08N10HN10174.3°174.5°
O09C08N10C115.7°5.5°
HN10N10C11C168.2°25.1°
HN10N10C11C12168.6°155.1°
N10C11C16C12176.8°179.7°
N10C11C12H122.5°0.0°
N10C11C12C13177.5°180.0°
N10C11C16C15178.2°179.7°
N10C11C16C174.2°0.0°
C16C11C12H12179.4°179.7°
C16C11C12C130.6°0.3°
C11C16C15C141.4°0.6°
C11C16C15C17177.7°179.7°
C11C16C15H15178.6°179.7°
C11C16C17C22100.7°104.7°
C11C16C17C1863.9°75.0°
C11C12H12C13180.0°180.0°
C11C12C13C140.2°0.0°
C11C12C13H13179.8°179.9°
C12C11C16C151.4°0.6°
C12C11C16C17179.0°179.7°
H12C12C13C14179.8°180.0°
H12C12C13H130.2°0.1°
C12C13C14H13180.0°179.9°
C12C13C14C150.1°0.0°
C12C13C14C23179.9°179.9°
C13C14C15C23180.0°179.9°
C13C14C15C160.7°0.3°
C13C14C15H15179.3°180.0°
C13C14C23C28122.3°59.7°
C13C14C23C24100.5°60.0°
C13C14C23H2314.3°179.9°
H13C13C14C15179.9°179.9°
H13C13C14C230.1°0.0°
C14C15C16H15180.0°179.7°
C14C15C16C17179.1°179.7°
C15C14C23C2857.7°120.3°
C15C14C23C2479.5°120.1°
C15C14C23H23165.8°0.0°
C23C14C15C16179.3°179.7°
C23C14C15H150.7°0.0°
C14C23C28C24136.3°119.9°
C14C23C28H23109.9°120.2°
C14C23C24H23112.0°120.1°
C14C23C24H2425.7°57.6°
C14C23C24C25145.7°177.6°
C14C23C24H24A94.3°62.5°
C14C23C28C27151.7°177.5°
C14C23C28H2888.3°62.5°
C14C23C28H28A31.7°57.6°
C15C16C17C2276.9°74.9°
C15C16C17C18118.5°105.3°
H15C15C16C170.9°0.0°
C16C17C22C18164.9°179.8°
C16C17C18C19175.7°179.5°
C16C17C18H184.3°0.4°
C16C17C22C21175.2°162.7°
C16C17C22H22A55.2°42.7°
C16C17C22H2264.8°77.0°
C22C17C18C1911.2°0.7°
C22C17C18H18168.8°179.3°
C17C22C21C2043.8°50.0°
C17C22C21H21A163.8°169.6°
C17C22C21H2176.1°69.7°
C17C22C21H22A120.0°119.9°
C17C22C21H22120.0°120.5°
C17C22H22AH22117.8°119.9°
C17C18C19H18180.0°180.0°
C17C18C19C2025.6°17.2°
C17C18C19H19A145.6°137.3°
C17C18C19H1994.4°103.0°
C18C17C22C2119.9°17.6°
C18C17C22H22A139.9°137.6°
C18C17C22H22100.1°102.8°
C18C19C20H19A120.0°120.2°
C18C19C20H19120.0°120.3°
C18C19H19AH19118.9°119.7°
C18C19C20H20A72.5°70.2°
C18C19C20H20167.5°169.4°
C18C19C20C2147.5°49.7°
H18C18C19C20154.4°162.8°
H18C18C19H19A34.4°42.7°
H18C18C19H1985.6°76.9°
C20C19H19AH19118.9°119.6°
C19C20H20AH20119.8°120.4°
C19C20H20AC21120.4°119.1°
C19C20H20C21120.4°119.0°
C19C20C21H21A178.0°172.4°
C19C20C21H2162.0°51.8°
C19C20C21C2257.9°68.1°
H19AC19C20H20A47.5°50.0°
H19AC19C20H2072.6°70.5°
H19AC19C20C21167.4°169.9°
H19C19C20H20A167.5°169.5°
H19C19C20H2047.4°49.1°
H19C19C20C2172.5°70.6°
H20AC20H20C21119.8°120.6°
H20AC20C21H21A58.0°67.8°
H20AC20C21H21178.0°171.6°
H20AC20C21C2262.0°51.7°
H20C20C21H21A62.0°52.7°
H20C20C21H2158.0°67.9°
H20C20C21C22178.0°172.2°
C20C21H21AH21119.0°120.4°
C20C21H21AC22122.0°118.8°
C20C21H21C22122.0°119.0°
C20C21C22H22A163.9°169.9°
C20C21C22H2276.2°70.5°
H21AC21H21C22119.0°120.6°
H21AC21C22H22A76.1°70.6°
H21AC21C22H2243.8°49.0°
H21C21C22H22A43.9°50.2°
H21C21C22H22163.9°169.8°
C21C22H22AH22117.8°119.7°
C28C23C24H23109.3°120.0°
C28C23C24H24113.0°62.3°
C28C23C24C257.0°57.7°
C28C23C24H24A127.0°177.6°
C23C28C27N2621.8°59.1°
C23C28C27H2798.2°179.2°
C23C28C27H28120.0°120.0°
C23C28C27H28A120.0°120.0°
C23C28C27H27A141.8°60.8°
C23C28H28H28A116.9°120.2°
C23C24H24C25124.7°119.9°
C23C24H24H24A117.7°120.1°
C23C24C25H24A120.0°120.0°
C23C24C25H25A81.9°60.8°
C23C24C25H25158.1°179.2°
C23C24C25N2638.1°59.2°
C24C23C28C2715.4°57.6°
C24C23C28H28135.4°177.6°
C24C23C28H28A104.6°62.2°
H23C23C24H24137.7°177.7°
H23C23C24C25102.3°62.3°
H23C23C24H24A17.7°57.6°
H23C23C28C2798.4°62.3°
H23C23C28H2821.6°57.7°
H23C23C28H28A141.6°177.8°
H24C24C25H24A120.0°120.1°
H24C24C25H25A38.1°179.2°
H24C24C25H2581.9°59.2°
H24C24C25N26158.1°60.8°
C24C25H25AH25120.8°120.0°
C24C25H25AN26118.3°120.0°
C24C25H25N26118.3°120.0°
C24C25N26C2779.0°61.7°
C24C25N26HN26161.0°62.4°
H24AC24C25H25A158.1°59.2°
H24AC24C25H2538.1°60.9°
H24AC24C25N2681.9°179.2°
H25AC25H25N26120.8°119.9°
H25AC25N26C2741.0°58.3°
H25AC25N26HN2679.0°177.6°
H25C25N26C27161.0°178.3°
H25C25N26HN2641.0°57.6°
C25N26C27HN26120.0°124.2°
C25N26C27H2750.2°178.3°
C25N26C27C2869.8°61.7°
C25N26C27H27A170.2°58.2°
N26C27H27C28120.1°120.1°
N26C27H27H27A120.0°120.0°
N26C27C28H27A120.0°120.0°
N26C27C28H2898.2°179.2°
N26C27C28H28A141.8°60.8°
HN26N26C27H2769.8°57.6°
HN26N26C27C28170.2°62.5°
HN26N26C27H27A50.2°177.6°
H27C27C28H27A120.0°120.0°
H27C27C28H28141.8°60.8°
H27C27C28H28A21.8°59.2°
C27C28H28H28A116.9°120.0°
H27AC27C28H2821.8°59.2°
H27AC27C28H28A98.2°179.2°

222415

PDB entries from 2024-07-10

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