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SummaryGeometryRelated PDB entries

R98

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C06C07doub1.39Å1.39ÅAromatic
C06C05sing1.39Å1.39ÅAromatic
C07C08sing1.38Å1.39ÅAromatic
C05C04doub1.38Å1.39ÅAromatic
C08N09doub1.32Å1.32ÅAromatic
C04N09sing1.32Å1.32ÅAromatic
C04C03sing1.51Å1.52Å
C01N02sing1.47Å1.45Å
C03N02sing1.47Å1.45Å
N02C10sing1.38Å1.44Å
C21C20doub1.38Å1.39ÅAromatic
C21C22sing1.39Å1.42ÅAromatic
C20C18sing1.39Å1.39ÅAromatic
C10N11doub1.33Å1.32ÅAromatic
C10C23sing1.40Å1.43ÅAromatic
C22C23sing1.47Å1.47ÅAromatic
C22C16doub1.40Å1.38ÅAromatic
N11C12sing1.32Å1.32ÅAromatic
C23C14doub1.40Å1.37ÅAromatic
C18F19sing1.35Å1.36Å
C18C17doub1.38Å1.38ÅAromatic
C16C17sing1.39Å1.41ÅAromatic
C16N15sing1.38Å1.35ÅAromatic
C12N13doub1.32Å1.31ÅAromatic
C14N13sing1.33Å1.35ÅAromatic
C14N15sing1.37Å1.34ÅAromatic
C17H171sing1.08Å1.08Å
C12H121sing1.08Å1.08Å
C20H201sing1.08Å1.08Å
C01H013sing1.09Å1.10Å
C01H012sing1.09Å1.10Å
C01H011sing1.09Å1.10Å
C03H031sing1.09Å1.10Å
C03H032sing1.09Å1.10Å
C05H051sing1.08Å1.08Å
C06H061sing1.08Å1.08Å
C07H071sing1.08Å1.08Å
C08H081sing1.08Å1.08Å
C21H211sing1.08Å1.08Å
N15H151sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C07C06C05118.3°118.4°
C06C07C08119.0°119.2°
C07C06H061120.9°120.8°
C06C07H071120.5°120.4°
C06C05C04119.0°119.2°
C06C05H051120.5°120.4°
C05C06H061120.8°120.8°
C07C08N09121.4°120.7°
C08C07H071120.5°120.4°
C07C08H081119.3°119.6°
C05C04N09121.4°120.7°
C05C04C03117.8°119.6°
C04C05H051120.5°120.4°
C08N09C04121.0°121.8°
N09C08H081119.3°119.7°
N09C04C03120.7°119.7°
C04C03N02114.6°109.5°
C04C03H031108.2°109.5°
C04C03H032108.2°109.5°
C01N02C03121.5°111.0°
C01N02C10120.8°111.0°
N02C01H013109.5°109.5°
N02C01H012109.5°109.5°
N02C01H011109.5°109.5°
C03N02C10117.3°111.0°
N02C03H031108.2°109.5°
N02C03H032108.2°109.5°
N02C10N11116.2°120.7°
N02C10C23125.8°120.8°
C20C21C22119.9°119.8°
C21C20C18120.6°120.3°
C21C20H201119.7°119.8°
C20C21H211120.1°120.1°
C21C22C23136.8°133.7°
C21C22C16118.9°120.0°
C22C21H211120.0°120.1°
C20C18F19119.9°119.8°
C20C18C17119.7°120.5°
C18C20H201119.7°119.9°
N11C10C23117.9°118.5°
C10N11C12123.3°120.9°
C10C23C22136.5°134.6°
C10C23C14116.9°118.8°
C23C22C16104.3°106.3°
C22C23C14106.6°106.6°
C22C16C17120.9°119.4°
C22C16N15110.4°108.3°
N11C12N13120.7°122.6°
N11C12H121119.7°118.7°
C23C14N13120.4°118.4°
C23C14N15109.3°108.4°
F19C18C17120.5°119.7°
C18C17C16120.0°120.0°
C18C17H171120.0°120.0°
C17C16N15128.8°132.3°
C16C17H171120.0°120.0°
C16N15C14109.5°110.4°
C16N15H151125.2°124.8°
C12N13C14120.8°120.9°
N13C12H121119.7°118.7°
N13C14N15130.3°133.2°
C14N15H151125.3°124.8°
H013C01H012109.4°109.5°
H013C01H011109.5°109.5°
H012C01H011109.5°109.5°
H031C03H032109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
C07C06C05H061180.0°179.9°
C06C07C08H071180.0°180.0°
C07C06C05C040.8°0.0°
C06C07C08N090.1°0.0°
C07C06C05H051179.2°179.9°
C06C07C08H081179.9°180.0°
C05C06C07C080.2°0.0°
C06C05C04H051180.0°179.9°
C06C05C04N091.2°0.0°
C06C05C04C03179.6°179.7°
C05C06C07H071179.8°180.0°
C07C08N09H081180.0°180.0°
C07C08N09C040.2°0.0°
C08C07C06H061179.8°179.9°
C05C04N09C080.8°0.0°
C05C04N09C03178.4°179.7°
C05C04C03N02135.0°95.3°
C05C04C03H03114.2°144.7°
C05C04C03H032104.3°24.7°
C04C05C06H061179.2°179.9°
C08N09C04C03179.3°179.7°
N09C08C07H071179.9°180.0°
N09C04C03N0246.5°85.0°
N09C04C03H031167.3°35.0°
N09C04C03H03274.2°155.0°
N09C04C05H051178.9°179.9°
C04N09C08H081179.8°180.0°
C04C03N02C0151.8°66.1°
C04C03N02H031120.7°120.0°
C04C03N02H032120.8°120.0°
C04C03N02C10120.9°170.0°
C04C03H031H032117.7°120.0°
C03C04C05H0510.4°0.4°
C01N02C03C10172.7°124.0°
C01N02C10N1135.0°64.7°
C01N02C10C23148.3°115.2°
N02C01H013H012120.0°120.0°
N02C01H013H011120.0°120.0°
N02C01H012H011120.0°120.0°
C01N02C03H03168.9°174.0°
C01N02C03H032172.5°54.0°
C03N02C10N11137.8°59.3°
C03N02C10C2338.9°120.8°
C03N02C01H013180.0°65.8°
C03N02C01H01260.0°174.1°
C03N02C01H01160.0°54.1°
N02C03H031H032117.7°120.0°
N02C10N11C23176.9°179.9°
N02C10C23C223.6°0.0°
N02C10N11C12177.1°179.9°
N02C10C23C14177.1°180.0°
C10N02C01H0137.5°170.2°
C10N02C01H012112.5°50.2°
C10N02C01H011127.5°69.8°
C10N02C03H031118.3°50.0°
C10N02C03H0320.2°70.0°
C20C21C22H211180.0°180.0°
C21C20C18H201180.0°180.0°
C20C21C22C23179.9°180.0°
C20C21C22C160.1°0.2°
C21C20C18F19179.8°180.0°
C21C20C18C170.4°0.2°
C22C21C20C180.3°0.0°
C21C22C23C100.5°0.0°
C21C22C23C16179.8°179.8°
C21C22C23C14179.8°180.0°
C21C22C16C170.4°0.2°
C21C22C16N15179.9°179.8°
C22C21C20H201179.7°180.0°
C20C18F19C17179.7°179.8°
C20C18C17C160.2°0.3°
C20C18C17H171179.8°179.7°
C18C20C21H211179.7°180.0°
N11C10C23C22179.8°180.0°
N11C10C23C140.5°0.0°
C10N11C12N130.2°0.0°
C10N11C12H121179.8°179.9°
C10C23C22C14179.4°180.0°
C10C23C22C16179.3°179.8°
C23C10N11C120.2°0.0°
C10C23C14N130.4°0.0°
C10C23C14N15179.8°179.6°
C23C22C16C17179.7°180.0°
C23C22C16N150.3°0.1°
C22C23C14N13179.9°180.0°
C22C23C14N150.3°0.4°
C23C22C21H2110.1°0.0°
C16C22C23C140.0°0.2°
C22C16C17C180.3°0.1°
C22C16C17N15179.3°179.9°
C22C16N15C140.5°0.4°
C22C16C17H171179.7°179.9°
C16C22C21H211179.8°179.8°
C22C16N15H151179.5°180.0°
N11C12N13H121180.0°179.9°
N11C12N13C140.3°0.0°
C23C14N15C160.4°0.5°
C23C14N13C120.0°0.0°
C23C14N13N15179.8°179.5°
C23C14N15H151179.5°179.8°
F19C18C17C16179.9°180.0°
F19C18C17H1710.1°0.0°
F19C18C20H2010.2°0.0°
C18C17C16H171180.0°180.0°
C18C17C16N15179.6°180.0°
C17C18C20H201179.6°179.7°
C17C16N15C14179.9°179.7°
C17C16N15H1510.1°0.0°
C16N15C14N13179.8°180.0°
C16N15C14H151180.0°179.7°
N15C16C17H1710.4°0.0°
C12N13C14N15179.8°179.5°
C14N13C12H121179.7°179.9°
N13C14N15H1510.3°0.3°
H201C20C21H2110.3°0.0°
H013C01H012H011120.0°120.0°
H051C05C06H0610.8°0.0°
H061C06C07H0710.2°0.1°
H071C07C08H0810.1°0.0°

224931

PDB entries from 2024-09-11

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