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SummaryGeometryRelated PDB entries

IG3

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C25N26doub1.32Å1.33ÅAromatic
C25C24sing1.39Å1.39ÅAromatic
N26C27sing1.33Å1.39ÅAromatic
O29C28doub1.22Å1.24Å
C24N23doub1.32Å1.35ÅAromatic
C27C28sing1.47Å1.50Å
C27C22doub1.41Å1.41ÅAromatic
C28N30sing1.35Å1.36Å
C32C33sing1.51Å1.53Å
C32C31sing1.53Å1.53Å
N23C22sing1.33Å1.35ÅAromatic
C38C33doub1.38Å1.39ÅAromatic
C38C37sing1.38Å1.39ÅAromatic
C22N21sing1.35Å1.37Å
N30C31sing1.47Å1.49Å
N30C20sing1.36Å1.39Å
C33C34sing1.38Å1.41ÅAromatic
C37C36doub1.38Å1.41ÅAromatic
C34C35doub1.38Å1.40ÅAromatic
C36C35sing1.38Å1.40ÅAromatic
N21C20doub1.31Å1.42Å
C20S19sing1.76Å1.86Å
S19C18sing1.81Å1.87Å
C18C16sing1.51Å1.56Å
N15C16sing1.35Å1.49Å
N15C14sing1.39Å1.48Å
C16O17doub1.21Å1.21Å
C14N39doub1.30Å1.34ÅAromatic
C14S13sing1.76Å1.75ÅAromatic
N39C11sing1.33Å1.36ÅAromatic
C09C08doub1.38Å1.41ÅAromatic
C09C10sing1.39Å1.42ÅAromatic
C08C07sing1.38Å1.36ÅAromatic
S13C12sing1.76Å1.77ÅAromatic
C11C10sing1.48Å1.47Å
C11C12doub1.35Å1.41ÅAromatic
C10C40doub1.39Å1.40ÅAromatic
C07C06doub1.39Å1.40ÅAromatic
C40C06sing1.39Å1.42ÅAromatic
C06N05sing1.40Å1.47Å
N05S02sing1.66Å1.72Å
O03S02doub1.42Å1.50Å
S02C01sing1.81Å1.85Å
S02O04doub1.42Å1.47Å
C24H1sing1.08Å1.08Å
C01H2sing1.09Å1.10Å
C01H3sing1.09Å1.10Å
C01H4sing1.09Å1.10Å
N05H5sing0.97Å1.00Å
C07H6sing1.08Å1.08Å
C08H7sing1.08Å1.08Å
C09H8sing1.08Å1.08Å
C12H9sing1.08Å1.08Å
N15H10sing0.97Å1.00Å
C18H11sing1.09Å1.10Å
C18H12sing1.09Å1.10Å
C25H13sing1.08Å1.08Å
C31H14sing1.09Å1.10Å
C31H15sing1.09Å1.10Å
C32H16sing1.09Å1.10Å
C32H17sing1.09Å1.10Å
C34H18sing1.08Å1.08Å
C35H19sing1.08Å1.08Å
C36H20sing1.08Å1.08Å
C37H21sing1.08Å1.08Å
C38H22sing1.08Å1.08Å
C40H23sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
N26C25C24117.6°120.5°
C25N26C27122.0°119.6°
N26C25H13121.2°119.7°
C25C24N23121.7°120.7°
C25C24H1119.1°119.7°
C24C25H13121.2°119.7°
N26C27C28120.2°121.8°
N26C27C22119.5°120.1°
O29C28C27122.0°121.3°
O29C28N30120.7°121.2°
C24N23C22121.4°119.7°
N23C24H1119.2°119.7°
C28C27C22120.3°118.1°
C27C28N30117.3°117.5°
C27C22N23117.8°119.4°
C27C22N21119.6°119.2°
C28N30C31117.9°119.8°
C28N30C20121.4°120.4°
C33C32C31107.3°109.5°
C32C33C38119.8°120.0°
C32C33C34119.3°120.0°
C33C32H16110.0°109.5°
C33C32H17110.0°109.5°
C32C31N30112.2°109.4°
C32C31H14108.8°109.5°
C32C31H15108.8°109.5°
C31C32H16110.0°109.5°
C31C32H17110.0°109.5°
N23C22N21122.4°121.5°
C33C38C37117.7°120.0°
C38C33C34120.9°120.0°
C33C38H22121.1°120.0°
C38C37C36121.6°120.0°
C38C37H21119.2°120.0°
C37C38H22121.1°120.0°
C22N21C20120.0°121.7°
C31N30C20120.7°119.8°
N30C31H14108.8°109.5°
N30C31H15108.8°109.4°
N30C20N21121.4°123.1°
N30C20S19118.0°118.4°
C33C34C35121.6°120.0°
C33C34H18119.2°120.0°
C37C36C35120.7°120.0°
C37C36H20119.6°120.0°
C36C37H21119.2°120.0°
C34C35C36117.6°120.0°
C35C34H18119.2°120.0°
C34C35H19121.2°120.0°
C36C35H19121.2°120.0°
C35C36H20119.7°120.0°
N21C20S19120.6°118.4°
C20S19C18108.0°100.0°
S19C18C16119.1°109.5°
S19C18H11107.0°109.5°
S19C18H12107.0°109.5°
C18C16N15119.4°120.0°
C18C16O17116.9°120.0°
C16C18H11107.0°109.5°
C16C18H12107.0°109.4°
C16N15C14125.0°120.0°
N15C16O17123.7°120.0°
C16N15H10117.4°120.0°
N15C14N39129.1°125.3°
N15C14S13123.9°125.3°
C14N15H10117.5°120.0°
N39C14S13106.9°109.4°
C14N39C11120.2°117.0°
C14S13C1293.0°90.0°
N39C11C10123.3°122.3°
N39C11C12111.4°115.4°
C08C09C10127.1°120.0°
C09C08C07118.0°120.2°
C09C08H7121.0°119.9°
C08C09H8116.4°120.0°
C09C10C11120.8°120.1°
C09C10C40112.6°119.8°
C10C09H8116.5°120.0°
C08C07C06117.8°120.2°
C08C07H6121.1°119.9°
C07C08H7121.0°119.9°
S13C12C11108.4°108.2°
S13C12H9125.8°125.9°
C10C11C12125.2°122.3°
C11C10C40126.6°120.0°
C11C12H9125.8°125.9°
C10C40C06120.7°119.8°
C10C40H23119.6°120.1°
C07C06C40123.7°120.0°
C07C06N05118.1°120.0°
C06C07H6121.1°119.9°
C40C06N05118.1°120.0°
C06C40H23119.6°120.1°
C06N05S02124.6°120.0°
C06N05H5105.6°120.0°
N05S02O03108.5°104.3°
N05S02C01110.4°104.4°
N05S02O04107.9°104.3°
S02N05H5105.6°120.0°
O03S02C01118.5°110.6°
O03S02O04101.4°121.0°
C01S02O04109.4°110.5°
S02C01H2109.5°109.5°
S02C01H3109.4°109.5°
S02C01H4109.5°109.5°
H2C01H3109.5°109.4°
H2C01H4109.5°109.5°
H3C01H4109.5°109.5°
H11C18H12109.4°109.4°
H14C31H15109.5°109.5°
H16C32H17109.4°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
N26C25C24H13180.0°179.9°
N26C25C24N232.4°0.0°
C25N26C27C28176.1°179.7°
C25N26C27C222.8°0.1°
N26C25C24H1177.6°180.0°
C24C25N26C270.0°0.1°
C25C24N23H1180.0°180.0°
C25C24N23C221.9°0.0°
N26C27C28O290.3°0.2°
N26C27C28C22178.8°179.9°
N26C27C28N30179.0°180.0°
N26C27C22N233.1°0.1°
N26C27C22N21178.8°180.0°
C27N26C25H13180.0°180.0°
O29C28C27N30178.7°179.8°
O29C28C27C22179.1°179.7°
O29C28N30C310.4°0.1°
O29C28N30C20177.7°179.9°
C24N23C22C270.9°0.0°
C24N23C22N21176.4°180.0°
N23C24C25H13177.6°179.9°
C28C27C22N23175.7°179.8°
C28C27C22N210.0°0.2°
C27C28N30C31178.3°180.0°
C27C28N30C203.6°0.1°
C22C27C28N302.2°0.1°
C27C22N23N21175.6°180.0°
C27C22N21C200.8°0.0°
C28N30C31C3288.5°90.0°
C28N30C31C20178.2°180.0°
C28N30C20N212.9°0.3°
C28N30C20S19178.9°180.0°
C28N30C31H14151.1°150.0°
C28N30C31H1531.9°29.9°
C33C32C31H16119.7°120.0°
C33C32C31H17119.7°120.0°
C32C33C38C34179.5°179.7°
C32C33C38C37179.9°179.7°
C33C32C31N30166.6°180.0°
C32C33C34C35179.6°180.0°
C33C32C31H1446.2°60.0°
C33C32C31H1573.0°60.1°
C33C32H16H17121.0°120.0°
C32C33C34H180.4°0.0°
C32C33C38H220.2°0.0°
C31C32C33C3856.1°90.3°
C32C31N30H14120.4°120.0°
C32C31N30H15120.4°120.0°
C32C31N30C2093.4°90.0°
C31C32C33C34123.4°90.0°
C32C31H14H15118.8°120.1°
C31C32H16H17121.0°120.0°
N23C22N21C20176.3°180.0°
C22N23C24H1178.1°180.0°
C33C38C37H22180.0°179.7°
C33C38C37C360.4°0.6°
C38C33C34C350.9°0.3°
C38C33C32H1663.6°149.7°
C38C33C32H17175.8°29.7°
C38C33C34H18179.1°179.7°
C33C38C37H21179.6°179.7°
C37C38C33C340.7°0.6°
C38C37C36H21180.0°179.7°
C38C37C36C350.3°0.3°
C38C37C36H20179.6°179.7°
C22N21C20N300.6°0.3°
C22N21C20S19178.7°180.0°
C31N30C20N21179.0°179.8°
C31N30C20S190.8°0.0°
N30C31H14H15118.7°120.0°
N30C31C32H1673.7°60.0°
N30C31C32H1746.9°60.0°
N30C20N21S19178.1°179.7°
N30C20S19C18172.4°179.7°
C20N30C31H1427.0°30.0°
C20N30C31H15146.2°150.0°
C33C34C35H18180.0°180.0°
C33C34C35C360.8°0.0°
C34C33C32H16116.9°30.0°
C34C33C32H173.7°150.0°
C33C34C35H19179.2°179.9°
C34C33C38H22179.3°179.7°
C37C36C35C340.5°0.0°
C37C36C35H20180.0°180.0°
C37C36C35H19179.4°179.9°
C36C37C38H22179.6°179.7°
C34C35C36H19180.0°179.9°
C34C35C36H20179.5°180.0°
C36C35C34H18179.2°180.0°
C35C36C37H21179.6°180.0°
N21C20S19C185.8°0.0°
C20S19C18C1692.6°180.0°
C20S19C18H1128.8°60.0°
C20S19C18H12146.0°60.0°
S19C18C16H11121.4°120.1°
S19C18C16H12121.4°120.0°
S19C18C16N1546.3°180.0°
S19C18C16O17134.7°0.0°
S19C18H11H12115.6°120.0°
C18C16N15O17178.9°180.0°
C18C16N15C14177.7°180.0°
C18C16N15H102.3°0.0°
C16C18H11H12115.6°119.9°
C16N15C14H10180.0°180.0°
C16N15C14N3998.4°180.0°
C16N15C14S1382.6°0.6°
N15C16C18H1175.1°59.9°
N15C16C18H12167.7°60.0°
C14N15C16O173.4°0.0°
N15C14N39S13179.1°179.5°
N15C14N39C11179.5°179.9°
N15C14S13C12179.7°179.7°
O17C16N15H10176.6°180.0°
O17C16C18H11103.9°120.1°
O17C16C18H1213.3°120.0°
N39C14S13C120.6°0.3°
C14N39C11C10178.9°179.8°
C14N39C11C121.6°0.4°
N39C14N15H1081.6°0.0°
S13C14N39C111.4°0.4°
C14S13C12C110.2°0.0°
C14S13C12H9179.8°180.0°
S13C14N15H1097.4°179.4°
N39C11C10C0970.4°179.5°
N39C11C12S130.9°0.2°
N39C11C10C12177.0°179.8°
N39C11C10C40108.4°0.2°
N39C11C12H9179.0°179.8°
C08C09C10H8180.0°180.0°
C09C08C07H7180.0°180.0°
C08C09C10C11179.9°179.7°
C08C09C10C400.9°0.0°
C09C08C07C060.5°0.1°
C09C08C07H6179.5°180.0°
C10C09C08C070.9°0.0°
C09C10C11C40178.8°179.7°
C09C10C11C12106.6°0.3°
C09C10C40C060.7°0.0°
C10C09C08H7179.1°180.0°
C09C10C40H23179.3°180.0°
C08C07C06H6180.0°180.0°
C08C07C06C400.4°0.0°
C08C07C06N05178.8°180.0°
C07C08C09H8179.1°180.0°
S13C12C11C10178.2°180.0°
S13C12C11H9180.0°180.0°
C11C10C40C06179.6°179.7°
C11C10C09H80.1°0.3°
C10C11C12H91.8°0.0°
C11C10C40H230.4°0.3°
C12C11C10C4074.7°180.0°
C10C40C06C070.5°0.0°
C10C40C06H23180.0°179.9°
C10C40C06N05179.0°180.0°
C40C10C09H8179.0°180.0°
C07C06C40N05178.5°180.0°
C07C06N05S0240.2°45.0°
C07C06N05H581.9°135.0°
C06C07C08H7179.5°180.0°
C07C06C40H23179.5°180.0°
C40C06N05S02141.2°135.0°
C40C06N05H596.7°45.0°
C40C06C07H6179.6°180.0°
C06N05S02H5122.1°180.0°
C06N05S02O033.7°51.1°
C06N05S02C01127.7°65.0°
C06N05S02O04112.8°178.9°
N05C06C07H61.2°0.0°
N05C06C40H231.0°0.1°
N05S02O03C01126.8°111.7°
N05S02O03O04113.5°116.7°
N05S02C01O04118.6°111.6°
N05S02C01H2180.0°180.0°
N05S02C01H360.0°60.1°
N05S02C01H460.0°60.0°
O03S02C01O04115.5°136.8°
O03S02C01H254.1°68.3°
O03S02C01H365.9°51.6°
O03S02C01H4174.1°171.6°
O03S02N05H5125.7°128.9°
S02C01H2H3120.0°120.0°
S02C01H2H4120.0°120.1°
S02C01H3H4120.0°120.1°
C01S02N05H55.6°115.0°
O04S02C01H261.4°68.4°
O04S02C01H3178.6°171.7°
O04S02C01H458.6°51.6°
O04S02N05H5125.1°1.1°
H1C24C25H132.3°0.1°
H2C01H3H4120.0°120.0°
H6C07C08H70.5°0.0°
H7C08C09H80.9°0.0°
H14C31C32H16165.9°179.9°
H14C31C32H1773.5°60.0°
H15C31C32H1646.7°60.0°
H15C31C32H17167.3°179.9°
H18C34C35H190.9°0.0°
H19C35C36H200.6°0.0°
H20C36C37H210.4°0.0°
H21C37C38H220.4°0.0°

222415

PDB entries from 2024-07-10

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