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SummaryGeometryRelated PDB entries

JKB

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C09N11sing1.47Å1.46Å
C09C10sing1.53Å1.51Å
O22C14doub1.22Å1.19Å
C14N11sing1.35Å1.48Å
C14C15sing1.48Å1.56Å
N11C12sing1.47Å1.45Å
C10N08sing1.47Å1.35Å
C20C15doub1.40Å1.39ÅAromatic
C20C19sing1.38Å1.41ÅAromatic
N08C07sing1.47Å1.26Å
N08C13sing1.47Å1.34Å
F21C04sing1.35Å1.32Å
C06C04doub1.38Å1.37ÅAromatic
C06C05sing1.38Å1.42ÅAromatic
C04C02sing1.38Å1.42ÅAromatic
C05C03doub1.38Å1.43ÅAromatic
C12C13sing1.53Å1.53Å
C15C17sing1.40Å1.41ÅAromatic
C02C01doub1.38Å1.43ÅAromatic
C03C01sing1.38Å1.37ÅAromatic
C03C07sing1.51Å1.56Å
C19C18doub1.38Å1.41ÅAromatic
C17N26sing1.48Å1.40Å
C17C16doub1.38Å1.39ÅAromatic
C18C16sing1.38Å1.38ÅAromatic
C18N23sing1.48Å1.48Å
O28N26doub1.22Å1.15Å
O25N23doub1.22Å1.19Å
C01H1sing1.08Å1.08Å
C02H2sing1.08Å1.08Å
C05H3sing1.08Å1.08Å
C06H4sing1.08Å1.08Å
C07H5sing1.09Å1.10Å
C07H6sing1.09Å1.10Å
C09H8sing1.09Å1.10Å
C09H9sing1.09Å1.10Å
C10H10sing1.09Å1.10Å
C10H11sing1.09Å1.10Å
C12H12sing1.09Å1.10Å
C12H13sing1.09Å1.10Å
C13H14sing1.09Å1.10Å
C13H15sing1.09Å1.10Å
C16H16sing1.08Å1.08Å
C19H17sing1.08Å1.08Å
C20H18sing1.08Å1.08Å
N23O24sing1.22Å1.41Å
N26O27sing1.22Å104.69Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
N11C09C10104.3°108.5°
C09N11C14117.4°120.9°
C09N11C12120.4°118.3°
N11C09H8110.8°109.7°
N11C09H9110.8°109.7°
C09C10N08109.0°109.3°
C10C09H8110.8°109.6°
C10C09H9110.7°109.6°
C09C10H10109.6°109.5°
C09C10H11109.6°109.4°
O22C14N11116.8°120.0°
O22C14C15116.6°120.0°
N11C14C15126.4°120.0°
C14N11C12122.2°120.8°
C14C15C20122.1°120.1°
C14C15C17118.2°120.2°
N11C12C13109.3°108.5°
N11C12H12109.5°109.7°
N11C12H13109.5°109.6°
C10N08C07107.7°111.0°
C10N08C13118.1°111.2°
N08C10H10109.6°109.5°
N08C10H11109.6°109.5°
C15C20C19119.2°119.8°
C20C15C17119.5°119.7°
C15C20H18120.4°120.1°
C20C19C18120.3°120.2°
C20C19H17119.9°119.9°
C19C20H18120.4°120.1°
C07N08C13107.8°111.0°
N08C07C03107.1°109.5°
N08C07H5110.1°109.5°
N08C07H6110.0°109.5°
N08C13C12115.5°109.3°
N08C13H14108.0°109.5°
N08C13H15107.9°109.5°
F21C04C06120.8°120.0°
F21C04C02118.5°120.0°
C04C06C05119.7°119.9°
C06C04C02120.8°120.0°
C04C06H4120.2°120.0°
C06C05C03119.8°120.1°
C06C05H3120.1°119.9°
C05C06H4120.2°120.0°
C04C02C01119.5°120.0°
C04C02H2120.3°120.0°
C05C03C01120.1°120.0°
C05C03C07121.2°120.0°
C03C05H3120.1°120.0°
C13C12H12109.5°109.6°
C13C12H13109.5°109.6°
C12C13H14107.9°109.5°
C12C13H15108.0°109.5°
C15C17N26122.8°120.1°
C15C17C16121.2°119.8°
C02C01C03120.2°120.0°
C02C01H1119.9°120.0°
C01C02H2120.3°120.0°
C01C03C07118.7°120.0°
C03C01H1119.9°120.0°
C03C07H5110.1°109.5°
C03C07H6110.1°109.5°
C19C18C16120.0°120.3°
C19C18N23125.3°119.9°
C18C19H17119.8°119.9°
N26C17C16116.0°120.1°
C17N26O28120.2°120.0°
C17N26O2782.8°120.0°
C17C16C18119.8°120.2°
C17C16H16120.1°119.9°
C16C18N23114.7°119.9°
C18C16H16120.1°119.9°
C18N23O25123.2°120.0°
C18N23O24117.0°120.0°
O28N26O2785.9°120.0°
O25N23O24119.8°120.1°
H5C07H6109.5°109.5°
H8C09H9109.5°109.8°
H10C10H11109.4°109.6°
H12C12H13109.5°109.8°
H14C13H15109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
N11C09C10H8119.2°119.7°
N11C09C10H9119.2°119.8°
C09N11C14O221.7°4.7°
C09N11C14C12179.4°180.0°
C09N11C14C15176.3°175.3°
N11C09C10N0860.9°53.8°
C09N11C12C1337.0°51.2°
N11C09H8H9122.4°120.5°
N11C09C10H1059.1°173.8°
N11C09C10H11179.2°66.1°
C09N11C12H1282.9°68.4°
C09N11C12H13157.0°170.9°
C10C09N11C14128.4°128.8°
C10C09N11C1252.2°51.2°
C09C10N08H10119.9°119.9°
C09C10N08H11120.0°119.9°
C09C10N08C07173.7°172.8°
C09C10N08C1364.0°63.1°
C10C09H8H9122.4°120.4°
C09C10H10H11120.2°120.0°
O22C14N11C15174.5°180.0°
O22C14N11C12178.9°175.3°
O22C14C15C2045.9°120.8°
O22C14C15C17128.8°59.5°
N11C14C15C20139.6°59.2°
C14N11C12C13143.6°128.8°
N11C14C15C1745.7°120.5°
C14N11C09H89.2°111.5°
C14N11C09H9112.5°9.1°
C14N11C12H1296.5°111.5°
C14N11C12H1323.6°9.1°
C15C14N11C124.3°4.7°
C14C15C20C17174.6°179.7°
C14C15C20C19176.9°180.0°
C14C15C17N263.5°0.0°
C14C15C17C16177.1°180.0°
C14C15C20H183.1°0.1°
N11C12C13N0829.8°53.9°
N11C12C13H12120.0°119.7°
N11C12C13H13120.0°119.7°
C12N11C09H8171.4°68.5°
C12N11C09H966.9°171.0°
N11C12H12H13120.1°120.6°
N11C12C13H1491.1°66.1°
N11C12C13H15150.6°173.8°
C10N08C07C13128.4°124.3°
C10N08C13C1247.2°63.1°
C10N08C07C03145.6°65.7°
C10N08C07H594.8°54.3°
C10N08C07H625.9°174.3°
N08C10C09H8179.9°65.9°
N08C10C09H958.3°173.6°
N08C10H10H11120.2°120.1°
C10N08C13H1473.7°56.8°
C10N08C13H15168.1°176.9°
C15C20C19H18180.0°179.9°
C15C20C19C181.0°0.1°
C20C15C17N26178.4°179.8°
C20C15C17C162.2°0.3°
C15C20C19H17178.9°179.7°
C19C20C15C172.3°0.3°
C20C19C18H17180.0°179.6°
C20C19C18C160.3°0.4°
C20C19C18N23179.0°180.0°
N08C07C03C0526.7°90.0°
C07N08C13C12169.5°172.8°
N08C07C03C01153.4°90.0°
N08C07C03H5119.6°120.0°
N08C07C03H6119.6°120.0°
N08C07H5H6121.1°120.0°
C07N08C10H1066.4°52.8°
C07N08C10H1153.8°67.3°
C07N08C13H1448.6°67.3°
C07N08C13H1569.7°52.8°
N08C13C12H14120.9°120.0°
N08C13C12H15120.9°119.9°
C13N08C07C0386.0°170.0°
C13N08C07H533.7°69.9°
C13N08C07H6154.4°50.1°
C13N08C10H1055.9°176.9°
C13N08C10H11176.0°56.8°
N08C13C12H1290.2°65.8°
N08C13C12H13149.8°173.6°
N08C13H14H15117.3°120.1°
F21C04C06C02179.5°179.9°
F21C04C06C05179.8°179.7°
F21C04C02C01179.7°180.0°
F21C04C02H20.3°0.0°
F21C04C06H40.2°0.0°
C04C06C05H4180.0°179.7°
C04C06C05C030.3°0.4°
C06C04C02C010.8°0.0°
C06C04C02H2179.2°180.0°
C04C06C05H3179.7°179.7°
C05C06C04C020.7°0.4°
C06C05C03H3180.0°179.9°
C06C05C03C010.0°0.0°
C06C05C03C07179.9°179.9°
C04C02C01H2180.0°180.0°
C04C02C01C030.5°0.3°
C04C02C01H1179.5°180.0°
C02C04C06H4179.3°180.0°
C05C03C01C020.1°0.3°
C05C03C01C07179.9°180.0°
C05C03C01H1179.9°180.0°
C03C05C06H4179.7°180.0°
C05C03C07H592.9°30.0°
C05C03C07H6146.3°150.0°
C13C12H12H13120.1°120.5°
C12C13H14H15117.3°120.0°
C15C17N26C16179.4°179.9°
C15C17C16C180.9°0.0°
C15C17N26O2858.2°6.9°
C15C17C16H16179.1°180.0°
C17C15C20H18177.8°179.7°
C15C17N26O2722.8°173.1°
C02C01C03H1180.0°179.8°
C02C01C03C07180.0°179.7°
C03C01C02H2179.5°179.7°
C01C03C05H3180.0°180.0°
C01C03C07H587.0°150.0°
C01C03C07H633.8°30.0°
C07C03C01H10.0°0.0°
C07C03C05H30.1°0.0°
C03C07H5H6121.1°120.0°
C19C18C16C170.3°0.3°
C19C18C16N23178.8°179.7°
C19C18N23O2511.7°0.3°
C19C18C16H16179.7°179.7°
C18C19C20H18179.0°180.0°
C19C18N23O24166.5°179.7°
N26C17C16C18179.7°179.9°
C17N26O28O2779.2°180.0°
N26C17C16H160.3°0.1°
C17C16C18H16180.0°180.0°
C17C16C18N23179.2°180.0°
C16C17N26O28122.3°173.2°
C16C17N26O27156.7°6.8°
C16C18N23O25169.6°180.0°
C16C18C19H17179.8°180.0°
C16C18N23O2412.3°0.0°
C18N23O25O24178.1°180.0°
N23C18C16H160.8°0.0°
N23C18C19H171.0°0.4°
H1C01C02H20.5°0.0°
H3C05C06H40.3°0.0°
H8C09C10H1060.1°54.0°
H8C09C10H1160.0°174.2°
H9C09C10H10178.2°66.5°
H9C09C10H1161.7°53.6°
H12C12C13H14148.9°174.2°
H12C12C13H1530.7°54.1°
H13C12C13H1428.9°53.6°
H13C12C13H1589.4°66.5°
H17C19C20H181.0°0.4°

219140

PDB entries from 2024-05-01

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