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SummaryGeometryRelated PDB entries

JS0

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C13C12sing1.53Å1.53Å
C13C14sing1.53Å1.53Å
O11C12sing1.43Å1.40Å
O11C10sing1.36Å1.42Å
O01C02sing1.43Å1.41Å
C14N15sing1.47Å1.28Å
C16N15sing1.47Å1.39Å
C16C17sing1.53Å1.53Å
C10C09doub1.37Å1.40ÅAromatic
C10C24sing1.41Å1.44ÅAromatic
C09C08sing1.39Å1.40ÅAromatic
N25C24doub1.34Å1.38ÅAromatic
N25C03sing1.31Å1.34ÅAromatic
C24C06sing1.42Å1.36ÅAromatic
N15C23sing1.47Å1.38Å
C02C03sing1.51Å1.53Å
C17N18sing1.47Å1.37Å
C08C07doub1.36Å1.41ÅAromatic
C03C04doub1.39Å1.40ÅAromatic
C06C07sing1.41Å1.44ÅAromatic
C06C05doub1.41Å1.43ÅAromatic
C04C05sing1.37Å1.40ÅAromatic
C23C22sing1.53Å1.54Å
N18C22sing1.47Å1.38Å
N18C19sing1.47Å1.30Å
C19C20sing1.47Å1.54Å
C20C21trip1.17Å1.20Å
C02H1sing1.09Å1.10Å
C02H2sing1.09Å1.10Å
C04H3sing1.08Å1.08Å
C05H4sing1.08Å1.08Å
C07H5sing1.08Å1.08Å
C08H6sing1.08Å1.08Å
C09H7sing1.08Å1.08Å
C12H8sing1.09Å1.10Å
C12H9sing1.09Å1.10Å
C13H10sing1.09Å1.10Å
C13H11sing1.09Å1.10Å
C14H12sing1.09Å1.10Å
C14H13sing1.09Å1.10Å
C16H14sing1.09Å1.10Å
C16H15sing1.09Å1.10Å
C17H16sing1.09Å1.10Å
C17H17sing1.09Å1.10Å
C19H18sing1.09Å1.10Å
C19H19sing1.09Å1.10Å
C21H20sing1.05Å1.06Å
C22H21sing1.09Å1.10Å
C22H22sing1.09Å1.10Å
C23H23sing1.09Å1.10Å
C23H24sing1.09Å1.10Å
O01H27sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C12C13C14104.0°109.5°
C13C12O11104.8°109.5°
C13C12H8110.6°109.4°
C13C12H9110.6°109.5°
C12C13H10110.8°109.5°
C12C13H11110.8°109.4°
C13C14N15111.8°109.5°
C14C13H10110.8°109.5°
C14C13H11110.8°109.5°
C13C14H12108.9°109.5°
C13C14H13108.9°109.5°
C12O11C10114.5°117.0°
O11C12H8110.6°109.5°
O11C12H9110.6°109.5°
O11C10C09122.2°120.2°
O11C10C24116.6°120.2°
O01C02C0399.4°109.5°
O01C02H1112.0°109.5°
O01C02H2112.0°109.5°
C02O01H27109.5°114.0°
C14N15C16108.5°111.0°
C14N15C23104.3°111.0°
N15C14H12108.9°109.5°
N15C14H13108.9°109.5°
N15C16C17112.7°109.4°
C16N15C23114.7°110.8°
N15C16H14108.6°109.6°
N15C16H15108.6°109.5°
C16C17N18111.0°109.3°
C17C16H14108.7°109.5°
C17C16H15108.7°109.5°
C16C17H16109.1°109.4°
C16C17H17109.1°109.5°
C09C10C24121.1°119.6°
C10C09C08118.6°121.0°
C10C09H7120.7°119.5°
C10C24N25118.6°121.1°
C10C24C06119.8°119.1°
C09C08C07120.9°121.0°
C09C08H6119.6°119.5°
C08C09H7120.7°119.6°
C24N25C03121.6°121.3°
N25C24C06121.6°119.9°
N25C03C02119.3°119.1°
N25C03C04118.9°121.7°
C24C06C07120.0°119.6°
C24C06C05119.1°119.0°
N15C23C22118.3°109.4°
N15C23H23107.2°109.4°
N15C23H24107.2°109.5°
C02C03C04121.6°119.1°
C03C02H1111.9°109.4°
C03C02H2111.9°109.5°
C17N18C22113.5°110.9°
C17N18C19111.4°111.0°
N18C17H16109.1°109.5°
N18C17H17109.1°109.5°
C08C07C06119.6°119.7°
C08C07H5120.2°120.1°
C07C08H6119.6°119.5°
C03C04C05121.3°119.9°
C03C04H3119.3°120.1°
C07C06C05121.0°121.4°
C06C07H5120.2°120.1°
C06C05C04117.4°118.1°
C06C05H4121.3°120.9°
C05C04H3119.4°120.0°
C04C05H4121.3°120.9°
C23C22N18116.7°109.4°
C23C22H21107.7°109.4°
C23C22H22107.6°109.5°
C22C23H23107.2°109.5°
C22C23H24107.2°109.5°
C22N18C19111.8°111.0°
N18C22H21107.6°109.5°
N18C22H22107.6°109.6°
N18C19C20112.9°109.5°
N18C19H18108.6°109.5°
N18C19H19108.6°109.5°
C19C20C21179.5°180.0°
C20C19H18108.6°109.5°
C20C19H19108.6°109.5°
C20C21H20180.0°179.9°
H1C02H2109.5°109.4°
H8C12H9109.5°109.5°
H10C13H11109.5°109.4°
H12C14H13109.5°109.4°
H14C16H15109.5°109.5°
H16C17H17109.5°109.5°
H18C19H19109.5°109.5°
H21C22H22109.4°109.5°
H23C23H24109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
C12C13C14H10119.1°120.1°
C12C13C14H11119.1°120.0°
C13C12O11H8119.3°120.0°
C13C12O11H9119.2°120.0°
C13C12O11C10166.3°180.0°
C12C13C14N15110.0°180.0°
C13C12H8H9122.1°120.0°
C12C13H10H11122.5°120.0°
C12C13C14H12129.6°60.0°
C12C13C14H1310.3°60.0°
C14C13C12O11130.1°180.0°
C13C14N15H12120.4°120.1°
C13C14N15H13120.4°120.0°
C13C14N15C1687.1°170.0°
C13C14N15C23150.2°66.2°
C14C13C12H810.8°60.0°
C14C13C12H9110.7°60.0°
C14C13H10H11122.5°120.0°
C13C14H12H13118.9°120.0°
C12O11C10C0931.5°0.0°
C12O11C10C24149.6°180.0°
O11C12H8H9122.2°120.1°
O11C12C13H1010.9°59.9°
O11C12C13H11110.8°60.0°
O11C10C09C24178.9°180.0°
O11C10C09C08179.0°180.0°
O11C10C24N250.8°0.3°
O11C10C24C06178.9°180.0°
O11C10C09H71.0°0.0°
C10O11C12H847.0°60.0°
C10O11C12H974.5°60.0°
O01C02C03N2584.3°179.7°
O01C02C03H1118.3°120.0°
O01C02C03H2118.4°120.0°
O01C02C03C0490.7°0.0°
O01C02H1H2124.8°120.1°
C14N15C16C23116.1°123.8°
C14N15C16C17161.2°176.8°
C14N15C23C22146.3°176.8°
N15C14C13H109.1°60.0°
N15C14C13H11130.8°60.0°
N15C14H12H13118.9°120.0°
C14N15C16H1478.3°63.2°
C14N15C16H1540.7°56.9°
C14N15C23H2325.0°56.8°
C14N15C23H2492.5°63.2°
N15C16C17H14120.5°120.1°
N15C16C17H15120.5°120.0°
N15C16C17N1860.1°58.4°
C16N15C23C2227.8°59.3°
C16N15C14H1233.3°50.0°
C16N15C14H13152.6°70.0°
N15C16H14H15118.5°120.1°
N15C16C17H1660.2°61.5°
N15C16C17H17179.7°178.4°
C16N15C23H2393.5°179.3°
C16N15C23H24149.1°60.7°
C17C16N15C2345.1°59.3°
C16C17N18H16120.2°119.9°
C16C17N18H17120.2°120.0°
C16C17N18C2254.6°59.3°
C16C17N18C19178.2°176.8°
C17C16H14H15118.5°120.0°
C16C17H16H17119.3°120.0°
C10C09C08H7180.0°179.9°
C09C10C24N25179.8°179.8°
C09C10C24C060.1°0.0°
C10C09C08C070.2°0.1°
C10C09C08H6179.9°180.0°
C24C10C09C080.1°0.0°
C10C24N25C06179.7°179.8°
C10C24N25C03179.6°179.7°
C10C24C06C070.1°0.0°
C10C24C06C05180.0°180.0°
C24C10C09H7179.9°180.0°
C09C08C07H6180.0°179.9°
C09C08C07C060.1°0.2°
C09C08C07H5179.9°179.9°
C24N25C03C02176.6°179.8°
C24N25C03C041.4°0.5°
N25C24C06C07179.8°179.8°
N25C24C06C050.3°0.3°
C03N25C24C060.7°0.5°
N25C03C02C04175.1°179.7°
N25C03C04C051.7°0.3°
N25C03C02H1157.3°60.2°
N25C03C02H234.0°59.7°
N25C03C04H3178.3°179.8°
C24C06C07C080.0°0.1°
C24C06C07C05179.8°180.0°
C24C06C05C040.6°0.0°
C24C06C05H4179.4°179.9°
C24C06C07H5180.0°180.0°
N15C23C22H23121.3°119.9°
N15C23C22H24121.3°120.0°
N15C23C22N1823.0°58.5°
C23N15C14H1289.4°173.7°
C23N15C14H1329.9°53.8°
C23N15C16H14165.6°60.7°
C23N15C16H1575.4°179.3°
N15C23C22H21144.0°178.4°
N15C23C22H2298.1°61.6°
N15C23H23H24116.0°120.0°
C02C03C04C05176.8°180.0°
C03C02H1H2124.7°120.0°
C02C03C04H33.2°0.1°
C03C02O01H27180.0°179.9°
C17N18C22C2337.3°59.4°
C17N18C22C19127.0°123.8°
C17N18C19C2049.9°170.0°
N18C17C16H14179.4°61.6°
N18C17C16H1560.4°178.4°
N18C17H16H17119.3°120.1°
C17N18C19H1870.6°50.0°
C17N18C19H19170.5°70.0°
C17N18C22H21158.4°179.2°
C17N18C22H2283.7°60.6°
C08C07C06H5180.0°179.9°
C08C07C06C05179.9°179.9°
C07C08C09H7179.8°179.9°
C03C04C05C061.3°0.0°
C03C04C05H3180.0°180.0°
C04C03C02H127.6°120.0°
C04C03C02H2150.9°120.0°
C03C04C05H4178.7°179.9°
C07C06C05C04179.6°180.0°
C07C06C05H40.4°0.0°
C06C07C08H6179.9°180.0°
C06C05C04H4180.0°180.0°
C06C05C04H3178.7°180.0°
C05C06C07H50.1°0.0°
C23C22N18H21121.1°119.9°
C23C22N18H22121.1°120.0°
C23C22N18C19164.4°176.8°
C23C22H21H22116.7°120.0°
C22C23H23H24116.0°120.1°
C22N18C19C2078.2°66.2°
C22N18C17H1665.6°60.6°
C22N18C17H17174.8°179.3°
C22N18C19H18161.2°173.7°
C22N18C19H1942.3°53.8°
N18C22H21H22116.7°120.1°
N18C22C23H2398.3°178.4°
N18C22C23H24144.3°61.5°
N18C19C20H18120.5°120.0°
N18C19C20H19120.5°120.0°
N18C19C20C2162.1°36.0°
C19N18C17H1661.6°63.3°
C19N18C17H1757.9°56.9°
N18C19H18H19118.4°120.0°
C19N18C22H2174.6°56.9°
C19N18C22H2243.3°63.2°
C20C19H18H19118.4°120.0°
C19C20C21H20140.7°138.9°
C21C20C19H1858.5°84.0°
C21C20C19H19177.4°156.0°
H1C02O01H2761.7°60.0°
H2C02O01H2761.7°60.0°
H3C04C05H41.3°0.0°
H5C07C08H60.1°0.0°
H6C08C09H70.2°0.1°
H8C12C13H10108.3°60.0°
H8C12C13H11129.9°180.0°
H9C12C13H10130.2°180.0°
H9C12C13H118.4°60.1°
H10C13C14H12111.3°180.0°
H10C13C14H13129.4°60.0°
H11C13C14H1210.5°60.0°
H11C13C14H13108.8°180.0°
H14C16C17H1660.3°178.4°
H14C16C17H1759.2°58.3°
H15C16C17H16179.4°58.4°
H15C16C17H1759.9°61.6°
H21C22C23H2322.8°61.7°
H21C22C23H2494.7°58.3°
H22C22C23H23140.7°58.3°
H22C22C23H2423.2°178.4°

220472

PDB entries from 2024-05-29

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