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KRL

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
H01C01sing1.09Å1.10Å
H01AC01sing1.09Å1.10Å
H01BC01sing1.09Å1.10Å
C01N02sing1.47Å1.50Å
C07N02sing1.47Å1.46Å
N02C03sing1.47Å1.47Å
H03C03sing1.09Å1.10Å
C03H03Asing1.09Å1.10Å
C03C04sing1.53Å1.58Å
N05C04sing1.47Å1.48Å
H04AC04sing1.09Å1.10Å
C04H04sing1.09Å1.10Å
C06N05sing1.47Å1.49Å
N05C08sing1.40Å1.51Å
C07C06sing1.53Å1.58Å
H06C06sing1.09Å1.10Å
C06H06Asing1.09Å1.10Å
H07AC07sing1.09Å1.10Å
H07C07sing1.09Å1.10Å
C09C08doub1.39Å1.40ÅAromatic
C08C23sing1.39Å1.43ÅAromatic
H09C09sing1.08Å1.08Å
C09C10sing1.38Å1.41ÅAromatic
H10C10sing1.08Å1.08Å
C10C11doub1.39Å1.41ÅAromatic
C11C22sing1.39Å1.43ÅAromatic
C11N12sing1.40Å1.45Å
C13N12sing1.35Å1.41Å
N12HN12sing0.97Å1.00Å
O14C13doub1.22Å1.23Å
C13C15sing1.47Å1.52Å
C15C16doub1.37Å1.38ÅAromatic
C15O21sing1.35Å1.37ÅAromatic
H16C16sing1.08Å1.08Å
C16C17sing1.40Å1.44ÅAromatic
C17H17sing1.08Å1.08Å
C17C18doub1.38Å1.38ÅAromatic
O21C18sing1.35Å1.38ÅAromatic
C18C19sing1.43Å1.42Å
C19N20trip1.14Å1.16Å
C23C22doub1.39Å1.43ÅAromatic
C22N24sing1.40Å1.48Å
C23H23sing1.08Å1.08Å
N24C25sing1.47Å1.48Å
N24C29sing1.47Å1.49Å
H25C25sing1.09Å1.10Å
H25AC25sing1.09Å1.10Å
C25C26sing1.53Å1.54Å
C26H26Asing1.09Å1.10Å
C26H26sing1.09Å1.10Å
C26C27sing1.53Å1.52Å
C28C27sing1.53Å1.51Å
H27AC27sing1.09Å1.10Å
C27H27sing1.09Å1.10Å
C29C28sing1.53Å1.54Å
H28AC28sing1.09Å1.10Å
C28H28sing1.09Å1.10Å
H29AC29sing1.09Å1.10Å
C29H29sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
H01C01H01A109.5°109.5°
H01C01H01B109.4°109.4°
H01C01N02109.5°109.5°
H01AC01H01B109.5°109.5°
H01AC01N02109.5°109.5°
H01BC01N02109.5°109.5°
C01N02C07118.6°111.0°
C01N02C03120.1°111.0°
C07N02C03119.2°110.9°
N02C07C06119.4°109.4°
N02C07H07A106.3°109.5°
N02C07H07106.3°109.5°
N02C03H03106.3°109.5°
N02C03H03A106.2°109.5°
N02C03C04119.5°109.4°
H03C03H03A112.5°109.5°
H03C03C04106.3°109.5°
H03AC03C04106.3°109.4°
C03C04N05122.5°109.3°
C03C04H04A105.4°109.5°
C03C04H04105.3°109.5°
N05C04H04A105.3°109.4°
N05C04H04105.3°109.5°
C04N05C06115.4°110.9°
C04N05C08120.8°111.0°
H04AC04H04113.3°109.5°
C06N05C08123.5°111.0°
N05C06C07122.6°109.3°
N05C06H06105.3°109.5°
N05C06H06A105.3°109.4°
N05C08C09124.9°120.0°
N05C08C23122.9°119.9°
C07C06H06105.3°109.5°
C07C06H06A105.3°109.5°
C06C07H07A106.3°109.5°
C06C07H07106.3°109.5°
H06C06H06A113.2°109.5°
H07AC07H07112.4°109.5°
C09C08C23112.0°120.1°
C08C09H09117.8°119.9°
C08C09C10124.3°120.1°
C08C23C22125.1°119.9°
C08C23H23117.5°120.1°
H09C09C10117.8°120.0°
C09C10H10118.2°120.0°
C09C10C11123.7°120.1°
H10C10C11118.1°119.9°
C10C11C22113.9°120.0°
C10C11N12126.3°120.0°
C22C11N12119.7°120.0°
C11C22C23121.0°119.9°
C11C22N24114.3°120.1°
C11N12C13133.5°120.0°
C11N12HN12113.2°120.0°
C13N12HN12113.2°120.0°
N12C13O14124.6°120.0°
N12C13C15121.3°120.0°
O14C13C15114.2°120.0°
C13C15C16131.2°125.7°
C13C15O21118.3°125.7°
C16C15O21110.4°108.6°
C15C16H16126.8°126.6°
C15C16C17106.4°107.0°
C15O21C18106.7°109.5°
H16C16C17126.8°126.4°
C16C17H17127.2°126.6°
C16C17C18105.5°106.8°
H17C17C18127.3°126.6°
C17C18O21110.9°108.1°
C17C18C19136.9°125.9°
O21C18C19112.2°125.9°
C18C19N20178.7°180.0°
C23C22N24124.7°120.1°
C22C23H23117.4°120.0°
C22N24C25112.1°111.0°
C22N24C29125.4°111.0°
C25N24C29119.8°111.2°
N24C25H25106.8°109.4°
N24C25H25A106.8°109.5°
N24C25C26117.6°109.5°
N24C29C28115.4°109.5°
N24C29H29A107.5°109.5°
N24C29H29107.5°109.5°
H25C25H25A112.0°109.4°
H25C25C26106.9°109.5°
H25AC25C26106.8°109.5°
C25C26H26A107.9°109.5°
C25C26H26107.9°109.5°
C25C26C27114.3°109.3°
H26AC26H26111.0°109.5°
H26AC26C27107.9°109.5°
H26C26C27107.9°109.5°
C26C27C28109.0°109.2°
C26C27H27A109.6°109.5°
C26C27H27109.6°109.5°
C28C27H27A109.7°109.6°
C28C27H27109.6°109.6°
C27C28C29107.2°109.2°
C27C28H28A110.2°109.5°
C27C28H28110.2°109.5°
H27AC27H27109.3°109.5°
C29C28H28A110.2°109.5°
C29C28H28110.2°109.5°
C28C29H29A107.6°109.5°
C28C29H29107.6°109.4°
H28AC28H28108.7°109.6°
H29AC29H29111.3°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
H01C01H01AH01B120.0°119.9°
H01C01H01AN02120.0°120.0°
H01C01H01BN02120.0°120.0°
H01C01N02C07180.0°176.2°
H01C01N02C0316.6°60.0°
H01AC01H01BN02120.0°120.0°
H01AC01N02C0760.0°56.2°
H01AC01N02C03136.6°180.0°
H01BC01N02C0760.0°63.8°
H01BC01N02C03103.4°60.0°
C01N02C07C03163.6°123.9°
C01N02C03H0389.8°175.5°
C01N02C03H03A30.2°55.4°
C01N02C03C04150.2°64.5°
C01N02C07C06151.4°64.5°
C01N02C07H07A31.4°175.5°
C01N02C07H0788.6°55.4°
C07N02C03H03106.8°60.6°
C07N02C03H03A133.2°179.3°
C07N02C03C0413.2°59.4°
N02C07C06N057.3°58.4°
N02C07C06H07A120.0°120.0°
N02C07C06H07120.0°120.0°
N02C07C06H06127.3°178.4°
N02C07C06H06A112.7°61.5°
N02C07H07AH07115.9°120.1°
N02C03H03H03A115.9°120.1°
N02C03H03C04128.2°119.9°
N02C03H03AC04128.3°119.9°
N02C03C04N059.4°58.4°
N02C03C04H04A129.4°61.5°
N02C03C04H04110.6°178.4°
C03N02C07C0612.2°59.4°
C03N02C07H07A132.2°60.6°
C03N02C07H07107.8°179.3°
H03C03H03AC04115.9°120.0°
H03C03C04N05110.6°61.6°
H03C03C04H04A9.4°178.5°
H03C03C04H04129.4°58.3°
H03AC03C04N05129.4°178.4°
H03AC03C04H04A110.7°58.5°
H03AC03C04H049.4°61.7°
C03C04N05H04A120.0°119.9°
C03C04N05H04120.0°120.0°
C03C04H04AH04114.6°120.1°
C03C04N05C064.2°59.3°
C03C04N05C08178.6°176.8°
N05C04H04AH04114.6°120.0°
C04N05C06C08174.2°123.9°
C04N05C06C073.2°59.3°
C04N05C06H06123.2°179.3°
C04N05C06H06A116.8°60.6°
C04N05C08C09117.5°0.4°
C04N05C08C2367.3°180.0°
H04AC04N05C06124.2°60.6°
H04AC04N05C0861.4°63.3°
H04C04N05C06115.8°179.3°
H04C04N05C0858.6°56.8°
N05C06C07H06120.0°120.0°
N05C06C07H06A120.0°119.9°
N05C06H06H06A114.6°120.0°
N05C06C07H07A127.3°61.6°
N05C06C07H07112.7°178.4°
C06N05C08C0956.4°123.5°
C06N05C08C23118.8°56.2°
C08N05C06C07177.4°176.8°
C08N05C06H0662.6°56.8°
C08N05C06H06A57.4°63.3°
N05C08C09C23175.7°179.7°
N05C08C09H093.8°0.1°
N05C08C09C10176.2°180.0°
N05C08C23C22176.1°179.8°
N05C08C23H233.9°0.0°
C07C06H06H06A114.6°120.1°
C06C07H07AH07115.9°120.0°
H06C06C07H07A112.7°58.4°
H06C06C07H077.3°61.7°
H06AC06C07H07A7.3°178.5°
H06AC06C07H07127.3°58.5°
C08C09H09C10180.0°179.9°
C08C09C10H10179.9°179.9°
C08C09C10C110.1°0.1°
C09C08C23C220.3°0.6°
C09C08C23H23179.7°179.6°
C23C08C09H09179.5°179.7°
C23C08C09C100.5°0.3°
C08C23C22C110.4°0.5°
C08C23C22H23180.0°179.8°
C08C23C22N24177.8°179.7°
H09C09C10H100.1°0.0°
H09C09C10C11179.9°180.0°
C09C10H10C11180.0°180.0°
C09C10C11C220.6°0.0°
C09C10C11N12177.1°179.9°
H10C10C11C22179.5°180.0°
H10C10C11N122.9°0.1°
C10C11C22N12176.8°179.9°
C10C11N12C1310.0°24.8°
C10C11N12HN12170.0°155.2°
C10C11C22C230.8°0.2°
C10C11C22N24178.4°180.0°
C22C11N12C13173.6°155.1°
C22C11N12HN126.4°24.9°
C11C22C23N24177.4°179.8°
C11C22C23H23179.6°179.7°
C11C22N24C25108.4°120.0°
C11C22N24C2952.8°115.8°
C11N12C13HN12180.0°180.0°
C11N12C13O145.3°5.5°
C11N12C13C15176.8°174.4°
N12C11C22C23177.6°179.7°
N12C11C22N244.8°0.0°
N12C13O14C15178.0°180.0°
N12C13C15C16163.5°180.0°
N12C13C15O2115.1°0.3°
HN12N12C13O14174.7°174.5°
HN12N12C13C153.2°5.5°
O14C13C15C1614.5°0.0°
O14C13C15O21166.9°179.7°
C13C15C16O21178.7°179.7°
C13C15C16H160.8°0.0°
C13C15C16C17179.3°180.0°
C13C15O21C18179.4°179.8°
C15C16H16C17180.0°180.0°
C15C16C17H17179.6°179.9°
C15C16C17C180.4°0.0°
C16C15O21C180.5°0.4°
O21C15C16H16179.5°179.7°
O21C15C16C170.6°0.2°
C15O21C18C170.3°0.4°
C15O21C18C19179.7°179.9°
H16C16C17H170.3°0.1°
H16C16C17C18179.7°180.0°
C16C17H17C18180.0°179.8°
C16C17C18O210.1°0.3°
C16C17C18C19180.0°180.0°
H17C17C18O21180.0°179.8°
H17C17C18C190.0°0.1°
C17C18O21C19180.0°179.7°
C17C18C19N20166.6°13.1°
O21C18C19N2013.4°167.3°
C23C22N24C2574.0°60.3°
C23C22N24C29124.7°64.0°
N24C22C23H232.2°0.1°
C22N24C25C29162.4°124.1°
C22N24C25H2560.2°65.8°
C22N24C25H25A59.8°54.1°
C22N24C25C26179.7°174.1°
C22N24C29C28156.0°174.1°
C22N24C29H29A84.0°65.9°
C22N24C29H2935.9°54.2°
N24C25H25H25A116.6°119.9°
N24C25H25C26126.7°120.0°
N24C25H25AC26126.7°120.0°
N24C25C26H26A114.9°60.8°
N24C25C26H26125.1°179.1°
N24C25C26C275.1°59.2°
C25N24C29C284.0°61.8°
C25N24C29H29A116.1°58.2°
C25N24C29H29124.0°178.3°
C29N24C25H25102.2°58.2°
C29N24C25H25A137.8°178.2°
C29N24C25C2617.8°61.8°
N24C29C28C2746.9°59.2°
N24C29C28H29A120.0°120.0°
N24C29C28H29120.0°120.0°
N24C29C28H28A73.1°60.7°
N24C29C28H28166.8°179.1°
N24C29H29AH29117.5°120.0°
H25C25H25AC26116.7°120.0°
H25C25C26H26A5.0°179.2°
H25C25C26H26114.9°59.2°
H25C25C26C27125.1°60.8°
H25AC25C26H26A125.1°59.2°
H25AC25C26H265.1°60.8°
H25AC25C26C27114.9°179.2°
C25C26H26AH26118.0°120.1°
C25C26H26AC27124.0°119.8°
C25C26H26C27124.0°119.8°
C25C26C27C2848.7°57.7°
C25C26C27H27A168.7°177.6°
C25C26C27H2771.3°62.3°
H26AC26H26C27118.0°120.1°
H26AC26C27C2871.3°62.3°
H26AC26C27H27A48.7°57.7°
H26AC26C27H27168.7°177.8°
H26C26C27C28168.7°177.6°
H26C26C27H27A71.3°62.4°
H26C26C27H2748.7°57.7°
C26C27C28H27A120.0°119.9°
C26C27C28H27120.0°119.9°
C26C27H27AH27120.2°120.1°
C26C27C28C2969.2°57.7°
C26C27C28H28A50.8°62.3°
C26C27C28H28170.8°177.6°
C28C27H27AH27120.2°120.2°
C27C28C29H28A120.0°119.9°
C27C28C29H28120.0°119.9°
C27C28H28AH28120.9°120.1°
C27C28C29H29A73.1°60.8°
C27C28C29H29166.9°179.2°
H27AC27C28C29170.8°177.6°
H27AC27C28H28A69.1°57.7°
H27AC27C28H2850.8°62.5°
H27C27C28C2950.8°62.2°
H27C27C28H28A170.9°177.8°
H27C27C28H2869.2°57.7°
C29C28H28AH28120.9°120.1°
C28C29H29AH29117.6°120.0°
H28AC28C29H29A166.8°179.3°
H28AC28C29H2946.9°59.3°
H28C28C29H29A46.8°59.1°
H28C28C29H2973.2°60.9°

225681

PDB entries from 2024-10-02

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