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SummaryGeometryRelated PDB entries

8S9

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
CL02C11sing1.74Å1.77Å
C12C11doub1.38Å1.36ÅAromatic
C12C13sing1.38Å1.39ÅAromatic
C11C16sing1.38Å1.36ÅAromatic
C13C14doub1.39Å1.39ÅAromatic
C16CL01sing1.74Å1.77Å
C16C15doub1.38Å1.37ÅAromatic
C14C15sing1.39Å1.38ÅAromatic
C14C10sing1.48Å1.52Å
C21C22doub1.38Å1.39ÅAromatic
C21C20sing1.40Å1.38ÅAromatic
C10N01sing1.35Å1.34ÅAromatic
C10C08doub1.38Å1.38ÅAromatic
C22C17sing1.38Å1.39ÅAromatic
N01C09doub1.31Å1.33ÅAromatic
C08C20sing1.48Å1.50Å
C08O03sing1.35Å1.33ÅAromatic
C20C19doub1.40Å1.39ÅAromatic
C17C18doub1.38Å1.40ÅAromatic
C09O03sing1.34Å1.34ÅAromatic
C09C06sing1.48Å1.49Å
O01C07doub1.21Å1.26Å
C05C06doub1.39Å1.38ÅAromatic
C05C04sing1.39Å1.38ÅAromatic
C07O02sing1.35Å1.27Å
C07C04sing1.48Å1.52Å
C19C18sing1.38Å1.39ÅAromatic
C06C01sing1.40Å1.39ÅAromatic
C04C03doub1.40Å1.39ÅAromatic
C01C02doub1.38Å1.39ÅAromatic
C03C02sing1.38Å1.38ÅAromatic
C01H1sing1.08Å1.08Å
C02H2sing1.08Å1.08Å
C03H3sing1.08Å1.08Å
C05H4sing1.08Å1.08Å
O02H5sing0.97Å0.95Å
C12H6sing1.08Å1.08Å
C13H7sing1.08Å1.08Å
C15H8sing1.08Å1.08Å
C17H9sing1.08Å1.08Å
C18H10sing1.08Å1.08Å
C19H11sing1.08Å1.08Å
C21H12sing1.08Å1.08Å
C22H13sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
CL02C11C12117.9°119.8°
CL02C11C16120.1°119.9°
C11C12C13119.3°120.1°
C12C11C16122.0°120.2°
C11C12H6120.4°120.0°
C12C13C14119.3°119.9°
C13C12H6120.4°119.9°
C12C13H7120.3°120.1°
C11C16CL01121.1°120.0°
C11C16C15119.4°120.1°
C13C14C15119.8°119.7°
C13C14C10124.9°120.2°
C14C13H7120.4°120.0°
CL01C16C15119.5°119.9°
C16C15C14120.2°119.9°
C16C15H8119.9°120.1°
C15C14C10114.7°120.1°
C14C15H8119.9°120.0°
C14C10N01120.2°126.5°
C14C10C08132.6°126.4°
C22C21C20118.7°119.9°
C21C22C17118.6°120.2°
C22C21H12120.7°120.1°
C21C22H13120.7°120.0°
C21C20C08123.0°120.2°
C21C20C19123.6°119.6°
C20C21H12120.6°120.0°
N01C10C08106.6°107.1°
C10N01C09107.2°108.9°
C10C08C20132.6°126.7°
C10C08O03109.2°106.7°
C22C17C18122.1°120.3°
C22C17H9118.9°119.9°
C17C22H13120.7°119.9°
N01C09O03111.1°109.4°
N01C09C06127.4°125.3°
C20C08O03118.1°126.7°
C08C20C19113.4°120.2°
C08O03C09105.9°107.9°
C20C19C18117.6°119.8°
C20C19H11121.2°120.0°
C17C18C19119.4°120.2°
C18C17H9119.0°119.8°
C17C18H10120.3°119.9°
O03C09C06121.6°125.3°
C09C06C05120.9°120.1°
C09C06C01116.9°120.1°
O01C07O02123.4°120.0°
O01C07C04119.5°120.0°
C06C05C04117.5°119.7°
C05C06C01122.0°119.9°
C06C05H4121.2°120.1°
C05C04C07121.2°120.1°
C05C04C03121.6°119.9°
C04C05H4121.2°120.2°
O02C07C04117.1°120.0°
C07O02H5109.5°117.0°
C07C04C03117.2°120.1°
C19C18H10120.3°119.9°
C18C19H11121.2°120.1°
C06C01C02119.3°120.2°
C06C01H1120.4°120.0°
C04C03C02120.0°120.1°
C04C03H3120.0°120.0°
C01C02C03119.5°120.3°
C02C01H1120.4°119.9°
C01C02H2120.3°119.9°
C03C02H2120.3°119.9°
C02C03H3120.0°119.9°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
CL02C11C12C16179.2°179.7°
CL02C11C12C13178.5°179.7°
CL02C11C16CL010.8°0.3°
CL02C11C16C15179.8°179.7°
CL02C11C12H61.5°0.3°
C11C12C13H6180.0°180.0°
C11C12C13C143.7°0.0°
C12C11C16CL01180.0°180.0°
C12C11C16C151.0°0.0°
C11C12C13H7176.3°180.0°
C13C12C11C160.7°0.0°
C12C13C14H7180.0°180.0°
C12C13C14C154.9°0.0°
C12C13C14C10174.7°179.9°
C11C16CL01C15179.0°180.0°
C11C16C15C140.3°0.0°
C16C11C12H6179.3°180.0°
C11C16C15H8179.7°180.0°
C13C14C15C163.2°0.0°
C13C14C15C10170.8°179.9°
C13C14C10N0140.3°137.5°
C13C14C10C08149.9°42.1°
C14C13C12H6176.3°180.0°
C13C14C15H8176.7°180.0°
CL01C16C15C14178.8°180.0°
CL01C16C15H81.3°0.0°
C16C15C14H8180.0°180.0°
C16C15C14C10174.0°180.0°
C15C14C10N01129.9°42.4°
C15C14C10C0839.8°138.0°
C15C14C13H7175.1°179.9°
C14C10N01C08172.2°179.6°
C14C10N01C09173.4°180.0°
C14C10C08C208.6°0.3°
C14C10C08O03173.6°180.0°
C10C14C13H75.3°0.0°
C10C14C15H85.9°0.1°
C22C21C20H12180.0°179.5°
C21C22C17H13180.0°179.4°
C22C21C20C08179.9°179.7°
C22C21C20C191.2°0.3°
C21C22C17C180.1°0.5°
C21C22C17H9179.9°179.7°
C21C20C08C1027.4°47.9°
C20C21C22C170.3°0.5°
C21C20C08C19179.1°180.0°
C21C20C08O03150.2°131.8°
C21C20C19C181.6°0.0°
C21C20C19H11178.4°180.0°
C20C21C22H13179.7°180.0°
N01C10C08C20179.4°179.9°
N01C10C08O032.9°0.4°
C10N01C09O030.8°0.2°
C10N01C09C06179.8°179.8°
C08C10N01C091.2°0.4°
C10C08C20O03177.6°179.7°
C10C08C20C19153.6°132.1°
C10C08O03C093.3°0.3°
C22C17C18H9180.0°179.7°
C22C17C18C190.3°0.3°
C22C17C18H10179.7°179.7°
C17C22C21H12179.7°180.0°
N01C09O03C082.6°0.0°
N01C09O03C06179.4°180.0°
N01C09C06C0512.7°0.0°
N01C09C06C01164.4°179.5°
C20C08O03C09178.5°180.0°
C08C20C19C18179.4°180.0°
C08C20C19H110.6°0.0°
C08C20C21H120.1°0.2°
O03C08C20C1928.8°48.2°
C08O03C09C06178.0°180.0°
C20C19C18C171.1°0.0°
C20C19C18H11180.0°180.0°
C20C19C18H10178.9°180.0°
C19C20C21H12178.8°179.8°
C17C18C19H10180.0°180.0°
C17C18C19H11178.9°180.0°
C18C17C22H13179.9°180.0°
O03C09C06C05166.7°180.0°
O03C09C06C0116.2°0.5°
C09C06C05C01177.0°179.5°
C09C06C05C04178.8°180.0°
C09C06C01C02179.3°180.0°
C09C06C01H10.7°0.2°
C09C06C05H41.2°0.5°
O01C07C04C0543.8°0.1°
O01C07O02C04179.3°179.9°
O01C07C04C03137.9°180.0°
O01C07O02H50.0°0.0°
C06C05C04H4180.0°179.5°
C06C05C04C07178.4°179.8°
C06C05C04C030.1°0.2°
C05C06C01C022.3°0.4°
C05C06C01H1177.7°179.7°
C05C04C07O02135.6°180.0°
C05C04C07C03178.3°179.9°
C04C05C06C011.9°0.5°
C05C04C03C021.7°0.1°
C05C04C03H3178.3°180.0°
O02C07C04C0342.7°0.1°
C07C04C03C02180.0°179.9°
C07C04C03H30.0°0.0°
C07C04C05H41.6°0.3°
C04C07O02H5179.4°180.0°
C19C18C17H9179.7°180.0°
C06C01C02H1180.0°179.8°
C06C01C02C030.6°0.1°
C06C01C02H2179.4°179.8°
C01C06C05H4178.1°180.0°
C04C03C02C011.3°0.1°
C04C03C02H3180.0°179.9°
C04C03C02H2178.7°180.0°
C03C04C05H4179.9°179.7°
C01C02C03H2180.0°179.9°
C01C02C03H3178.7°180.0°
C03C02C01H1179.4°180.0°
H1C01C02H20.6°0.1°
H2C02C03H31.3°0.1°
H6C12C13H73.7°0.1°
H9C17C18H100.3°0.0°
H9C17C22H130.1°0.3°
H10C18C19H111.1°0.0°
H12C21C22H130.3°0.5°

225681

PDB entries from 2024-10-02

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