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SummaryGeometryRelated PDB entries

UNQ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C05C01doub1.40Å1.43ÅAromatic
C01C03sing1.39Å1.41ÅAromatic
C01C13sing1.48Å1.48ÅAromatic
C04C02sing1.41Å1.41ÅAromatic
C02C08sing1.46Å1.48ÅAromatic
C02C03doub1.39Å1.37ÅAromatic
C03H03sing1.08Å1.08Å
O07C04sing1.35Å1.38ÅAromatic
C06C04doub1.39Å1.42ÅAromatic
C06C05sing1.38Å1.39ÅAromatic
C05H05sing1.08Å1.08Å
C06H06sing1.08Å1.08Å
O07C09sing1.35Å1.40ÅAromatic
C09C08doub1.36Å1.36ÅAromatic
C08H08sing1.08Å1.08Å
C10C09sing1.47Å1.52Å
O12C10doub1.22Å1.33Å
C10O11sing1.35Å1.25Å
O11HO11sing0.97Å0.95Å
C17C13doub1.39Å1.41ÅAromatic
C13N15sing1.33Å1.38ÅAromatic
N15C14doub1.33Å1.40ÅAromatic
C16C14sing1.39Å1.42ÅAromatic
C14N19sing1.39Å1.40Å
N18C16doub1.32Å1.35ÅAromatic
C16H16sing1.08Å1.08Å
C17N18sing1.32Å1.37ÅAromatic
C17H17sing1.08Å1.08Å
N19C20sing1.46Å1.51Å
N19HN19sing0.97Å1.00Å
C25C20sing1.53Å1.57Å
C20C21sing1.53Å1.57Å
C20H20sing1.09Å1.10Å
C21C22sing1.53Å1.56Å
C21H21sing1.09Å1.10Å
C21H21Asing1.09Å1.10Å
C23C22sing1.53Å1.55Å
C22H22sing1.09Å1.10Å
C22H22Asing1.09Å1.10Å
C24C23sing1.53Å1.54Å
C23N26sing1.47Å1.43Å
C23H23sing1.09Å1.10Å
C25C24sing1.53Å1.53Å
C24H24sing1.09Å1.10Å
C24H24Asing1.09Å1.10Å
C25H25sing1.09Å1.10Å
C25H25Asing1.09Å1.10Å
N26HN26sing1.01Å1.00Å
N26HN2Asing1.01Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C05C01C03120.7°120.0°
C05C01C13123.0°119.9°
C01C05C06124.0°120.6°
C01C05H05118.0°119.7°
C03C01C13116.2°120.0°
C01C03C02116.4°119.5°
C01C03H03121.8°120.2°
C01C13C17116.6°120.0°
C01C13N15124.3°120.1°
C04C02C08108.0°105.7°
C04C02C03122.1°120.3°
C02C04O07109.9°107.6°
C02C04C06123.6°119.4°
C08C02C03129.9°134.0°
C02C08C09101.7°106.0°
C02C08H08129.2°127.0°
C02C03H03121.8°120.3°
O07C04C06126.3°133.0°
C04O07C09104.2°110.9°
C04C06C05113.0°120.2°
C04C06H06123.5°119.9°
C06C05H05118.0°119.7°
C05C06H06123.5°119.9°
O07C09C08116.2°109.8°
O07C09C10117.6°125.1°
C09C08H08129.1°126.9°
C08C09C10125.9°125.1°
C09C10O12109.3°120.0°
C09C10O11123.3°120.0°
O12C10O11126.3°120.0°
C10O11HO11109.5°117.0°
C17C13N15118.9°119.9°
C13C17N18122.9°120.0°
C13C17H17118.5°120.0°
C13N15C14118.0°119.8°
N15C14C16121.0°119.9°
N15C14N19117.4°120.0°
C16C14N19121.6°120.1°
C14C16N18120.7°120.1°
C14C16H16119.7°119.9°
C14N19C20117.5°120.0°
C14N19HN19106.9°120.0°
N18C16H16119.6°120.0°
C16N18C17118.3°120.2°
N18C17H17118.5°120.0°
C20N19HN19106.9°120.0°
N19C20C25108.2°109.5°
N19C20C21109.5°109.5°
N19C20H20110.1°109.5°
C25C20C21109.1°109.5°
C25C20H20110.5°109.5°
C20C25C24110.4°109.5°
C20C25H25109.2°109.5°
C20C25H25A109.2°109.5°
C21C20H20109.3°109.5°
C20C21C22111.4°109.5°
C20C21H21108.8°109.4°
C20C21H21A108.8°109.5°
C22C21H21108.8°109.4°
C22C21H21A108.8°109.5°
C21C22C23112.7°109.4°
C21C22H22108.4°109.5°
C21C22H22A108.4°109.4°
H21C21H21A110.1°109.5°
C23C22H22108.4°109.5°
C23C22H22A108.4°109.5°
C22C23C24109.6°109.5°
C22C23N26114.9°109.4°
C22C23H23107.3°109.4°
H22C22H22A110.5°109.5°
C24C23N26113.8°109.5°
C24C23H23108.4°109.5°
C23C24C25111.0°109.5°
C23C24H24109.0°109.4°
C23C24H24A109.0°109.5°
N26C23H23102.3°109.5°
C23N26HN26109.5°111.0°
C23N26HN2A109.5°111.0°
C25C24H24109.0°109.4°
C25C24H24A109.0°109.5°
C24C25H25109.2°109.4°
C24C25H25A109.2°109.5°
H24C24H24A110.0°109.5°
H25C25H25A109.8°109.5°
HN26N26HN2A109.5°111.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
C05C01C03C13176.1°179.7°
C05C01C03C021.3°0.2°
C05C01C03H03178.7°179.8°
C01C05C06C044.7°0.0°
C01C05C06H05180.0°179.9°
C01C05C06H06175.3°179.7°
C05C01C13C1716.9°175.6°
C05C01C13N15156.6°4.8°
C01C03C02C040.4°0.5°
C01C03C02C08179.9°180.0°
C01C03C02H03180.0°180.0°
C03C01C05C061.5°0.0°
C03C01C05H05178.5°179.9°
C03C01C13C17167.2°4.7°
C03C01C13N1519.3°175.0°
C13C01C03C02174.8°180.0°
C13C01C03H035.2°0.0°
C13C01C05C06177.3°179.7°
C13C01C05H052.7°0.2°
C01C13C17N15173.9°179.7°
C01C13N15C14177.2°180.0°
C01C13C17N18179.1°180.0°
C01C13C17H170.9°0.0°
C04C02C08C03179.7°179.5°
C04C02C03H03179.6°179.5°
C02C04O07C06174.8°179.8°
C02C04C06C055.6°0.3°
C02C04C06H06174.4°180.0°
C02C04O07C090.4°0.0°
C04C02C08C091.9°0.0°
C04C02C08H08178.1°179.5°
C08C02C03H030.1°0.0°
C08C02C04O071.5°0.0°
C08C02C04C06176.5°179.9°
C02C08C09O071.8°0.0°
C02C08C09H08180.0°179.5°
C02C08C09C10175.4°180.0°
C03C02C04O07178.3°179.6°
C03C02C04C063.3°0.5°
C03C02C08C09177.8°179.5°
C03C02C08H082.2°0.0°
O07C04C06C05179.7°179.9°
O07C04C06H060.2°0.2°
C04O07C09C081.0°0.0°
C04O07C09C10175.2°180.0°
C04C06C05H06180.0°179.7°
C04C06C05H05175.3°179.9°
C06C04O07C09175.2°179.8°
H05C05C06H064.7°0.2°
O07C09C08C10173.6°180.0°
O07C09C08H08178.2°179.5°
O07C09C10O1213.1°180.0°
O07C09C10O11178.6°0.0°
C08C09C10O12160.5°0.1°
C08C09C10O117.9°179.9°
H08C08C09C104.5°0.5°
C09C10O12O11167.9°180.0°
C09C10O11HO11166.3°180.0°
O12C10O11HO110.0°0.0°
C17C13N15C143.8°0.3°
C13C17N18C163.0°0.0°
C13C17N18H17180.0°180.0°
C13N15C14C160.6°0.0°
C13N15C14N19178.4°180.0°
N15C13C17N185.2°0.3°
N15C13C17H17174.7°179.7°
N15C14C16N19178.9°180.0°
N15C14C16N181.7°0.3°
N15C14C16H16178.3°180.0°
N15C14N19C209.2°180.0°
N15C14N19HN19129.2°0.0°
C14C16N18H16180.0°179.7°
C14C16N18C170.5°0.3°
C16C14N19C20169.7°0.0°
C16C14N19HN1949.7°180.0°
N19C14C16N18179.4°179.7°
N19C14C16H160.6°0.0°
C14N19C20HN19120.0°180.0°
C14N19C20C2582.8°85.0°
C14N19C20C21158.3°155.0°
C14N19C20H2038.1°35.0°
C16N18C17H17177.0°180.0°
H16C16N18C17179.5°180.0°
N19C20C25C21119.1°120.0°
N19C20C25H20120.7°120.0°
N19C20C21H20120.7°120.0°
N19C20C21C22172.4°180.0°
N19C20C21H2167.6°60.1°
N19C20C21H21A52.4°60.0°
N19C20C25C24177.6°180.0°
N19C20C25H2557.6°60.0°
N19C20C25H25A62.4°60.0°
HN19N19C20C25157.1°95.0°
HN19N19C20C2138.3°25.0°
HN19N19C20H2081.9°145.0°
C25C20C21H20121.0°120.0°
C25C20C21C2254.1°60.0°
C25C20C21H21174.1°180.0°
C25C20C21H21A65.9°60.0°
C20C25C24C2361.6°60.0°
C20C25C24H25120.0°120.0°
C20C25C24H25A120.0°120.1°
C20C25C24H2458.4°60.0°
C20C25C24H24A178.4°180.0°
C20C25H25H25A119.6°120.1°
C20C21C22H21120.0°119.9°
C20C21C22H21A120.0°120.0°
C20C21H21H21A119.2°120.0°
C20C21C22C2353.4°60.0°
C20C21C22H2266.5°60.0°
C20C21C22H22A173.4°180.0°
C21C20C25C2458.5°60.0°
C21C20C25H2561.5°60.0°
C21C20C25H25A178.5°180.0°
H20C20C21C2266.9°60.0°
H20C20C21H2153.1°60.0°
H20C20C21H21A173.1°180.0°
H20C20C25C2461.7°60.0°
H20C20C25H25178.3°179.9°
H20C20C25H25A58.3°60.0°
C22C21H21H21A119.2°120.0°
C21C22C23H22120.0°120.0°
C21C22C23H22A120.0°119.9°
C21C22H22H22A118.7°120.0°
C21C22C23C2454.3°60.0°
C21C22C23N26176.1°180.0°
C21C22C23H2363.2°60.0°
H21C21C22C23173.4°180.0°
H21C21C22H2253.5°60.0°
H21C21C22H22A66.6°60.1°
H21AC21C22C2366.6°60.0°
H21AC21C22H22173.4°180.0°
H21AC21C22H22A53.4°60.0°
C23C22H22H22A118.7°120.0°
C22C23C24N26130.1°120.0°
C22C23C24H23116.8°120.0°
C22C23N26H23115.8°120.0°
C22C23C24C2558.4°60.0°
C22C23C24H2461.6°60.0°
C22C23C24H24A178.4°180.0°
C22C23N26HN26180.0°180.0°
C22C23N26HN2A60.0°56.1°
H22C22C23C2465.7°60.0°
H22C22C23N2663.9°60.0°
H22C22C23H23176.8°180.0°
H22AC22C23C24174.3°180.0°
H22AC22C23N2656.1°60.0°
H22AC22C23H2356.8°60.0°
C24C23N26H23116.7°120.0°
C23C24C25H24120.0°119.9°
C23C24C25H24A120.0°120.1°
C23C24H24H24A119.4°120.0°
C23C24C25H2558.4°60.0°
C23C24C25H25A178.4°180.0°
C24C23N26HN2652.5°60.0°
C24C23N26HN2A67.5°63.9°
N26C23C24C25171.4°180.0°
N26C23C24H2468.6°60.0°
N26C23C24H24A51.5°60.0°
C23N26HN26HN2A120.0°123.9°
H23C23C24C2558.4°60.0°
H23C23C24H24178.3°179.9°
H23C23C24H24A61.6°60.0°
H23C23N26HN2664.2°60.1°
H23C23N26HN2A175.8°176.0°
C25C24H24H24A119.4°120.0°
C24C25H25H25A119.6°120.0°
H24C24C25H25178.4°180.0°
H24C24C25H25A61.6°60.1°
H24AC24C25H2561.6°60.0°
H24AC24C25H25A58.4°59.9°

226262

PDB entries from 2024-10-16

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