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SummaryGeometryRelated PDB entries

A1I6X

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
N02C01sing1.46Å1.45Å
C03N02sing1.34Å1.32ÅAromatic
C04C03doub1.38Å1.37ÅAromatic
N06C05doub1.30Å1.34ÅAromatic
C07C05sing1.51Å1.53Å
F08C07sing1.40Å1.36Å
F09C07sing1.40Å1.36Å
C05C04sing1.41Å1.38ÅAromatic
C10C04sing1.47Å1.53Å
O11C10doub1.22Å1.19Å
N12C10sing1.35Å1.45Å
C13N12sing1.40Å1.45Å
C14C13doub1.40Å1.39ÅAromatic
C16C15doub1.38Å1.39ÅAromatic
C18C17doub1.38Å1.39ÅAromatic
C17C16sing1.39Å1.39ÅAromatic
F19C16sing1.35Å1.37Å
C15C14sing1.39Å1.39ÅAromatic
C20C14sing1.48Å1.53Å
C21C20doub1.39Å1.39ÅAromatic
C22C21sing1.38Å1.39ÅAromatic
C25C24doub1.38Å1.39ÅAromatic
C24C23sing1.38Å1.38ÅAromatic
CL26C23sing1.74Å1.79Å
C23C22doub1.39Å1.39ÅAromatic
CL27C22sing1.74Å1.78Å
N02N06sing1.40Å1.37ÅAromatic
C13C18sing1.39Å1.39ÅAromatic
C20C25sing1.39Å1.38ÅAromatic
H011C01sing1.09Å1.10Å
H012C01sing1.09Å1.10Å
H013C01sing1.09Å1.10Å
H031C03sing1.08Å1.08Å
H071C07sing1.09Å1.10Å
H121N12sing0.97Å1.00Å
H151C15sing1.08Å1.08Å
H171C17sing1.08Å1.08Å
H181C18sing1.08Å1.08Å
H211C21sing1.08Å1.08Å
H241C24sing1.08Å1.08Å
H251C25sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C01N02C03125.0°125.8°
C01N02N06125.0°125.7°
N02C01H011109.5°109.5°
N02C01H012109.5°109.5°
N02C01H013109.5°109.5°
N02C03C04107.7°107.5°
C03N02N06109.7°108.5°
N02C03H031126.2°126.3°
C03C04C05107.5°107.1°
C03C04C10126.0°126.5°
C04C03H031126.2°126.3°
N06C05C07126.0°125.9°
N06C05C04107.6°108.1°
C05N06N02107.5°108.9°
C05C07F08109.7°109.5°
C05C07F09109.7°109.4°
C07C05C04126.0°126.0°
C05C07H071108.1°109.5°
F08C07F09108.6°109.5°
F08C07H071110.3°109.4°
F09C07H071110.3°109.5°
C05C04C10125.9°126.4°
C04C10O11120.0°120.0°
C04C10N12120.0°120.0°
O11C10N12120.0°120.0°
C10N12C13120.0°120.0°
C10N12H121120.0°120.0°
N12C13C14119.9°120.1°
N12C13C18119.9°120.1°
C13N12H121120.0°120.0°
C13C14C15120.0°119.7°
C13C14C20120.0°120.1°
C14C13C18120.0°119.8°
C15C16C17120.0°120.2°
C15C16F19120.0°119.9°
C16C15C14120.0°119.9°
C16C15H151120.0°120.0°
C18C17C16120.0°120.3°
C17C18C13120.0°120.1°
C18C17H171120.0°119.9°
C17C18H181120.0°119.9°
C17C16F19120.0°119.9°
C16C17H171120.0°119.8°
C15C14C20120.0°120.2°
C14C15H151120.0°120.1°
C14C20C21119.9°120.2°
C14C20C25120.0°120.1°
C20C21C22119.9°119.9°
C21C20C25120.0°119.7°
C20C21H211120.0°120.0°
C21C22C23120.0°120.1°
C21C22CL27120.0°120.0°
C22C21H211120.0°120.1°
C25C24C23120.0°120.1°
C24C25C20120.0°119.9°
C25C24H241120.0°119.9°
C24C25H251120.0°120.1°
C24C23CL26120.0°119.9°
C24C23C22120.0°120.2°
C23C24H241120.0°119.9°
CL26C23C22120.0°119.9°
C23C22CL27120.0°120.0°
C13C18H181120.0°120.0°
C20C25H251120.0°120.0°
H011C01H012109.5°109.5°
H011C01H013109.5°109.4°
H012C01H013109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
C01N02C03N06174.6°179.7°
C01N02C03C04174.7°180.0°
C01N02N06C05174.7°179.8°
N02C01H011H012120.0°120.0°
N02C01H011H013120.0°120.0°
N02C01H012H013120.0°120.0°
C01N02C03H0315.4°0.1°
N02C03C04H031180.0°179.9°
C03N02N06C050.0°0.5°
N02C03C04C050.0°0.0°
N02C03C04C10172.1°180.0°
C03N02C01H011173.8°89.7°
C03N02C01H01266.1°30.4°
C03N02C01H01353.8°150.3°
C03C04C05N060.0°0.3°
C03C04C05C07172.6°180.0°
C03C04C05C10172.2°180.0°
C03C04C10O11180.0°180.0°
C03C04C10N121.7°0.0°
C04C03N02N060.0°0.3°
N06C05C07C04171.2°179.7°
N06C05C07F089.3°30.3°
N06C05C07F09110.0°150.3°
N06C05C04C10172.2°179.7°
N06C05C07H071129.7°89.7°
C05C07F08F09119.9°120.0°
C05C07F08H071119.0°120.0°
C05C07F09H071119.0°120.0°
C07C05C04C100.4°0.0°
C07C05N06N02172.5°179.8°
F08C07F09H071121.1°120.0°
F08C07C05C04179.5°150.0°
F09C07C05C0461.2°30.0°
C05C04C10O119.3°0.0°
C05C04C10N12169.1°180.0°
C04C05N06N020.0°0.5°
C05C04C03H031180.0°180.0°
C04C05C07H07159.1°90.0°
C04C10O11N12178.4°180.0°
C04C10N12C13178.3°174.5°
C10C04C03H0317.8°0.1°
C04C10N12H1211.7°5.5°
O11C10N12C130.0°5.5°
O11C10N12H121179.9°174.5°
C10N12C13H121180.0°180.0°
C10N12C13C14119.3°155.4°
C10N12C13C1865.6°24.9°
N12C13C14C18175.1°179.7°
N12C13C18C17175.1°179.7°
N12C13C14C15175.1°180.0°
N12C13C14C207.9°0.1°
N12C13C18H1814.9°0.0°
C13C14C15C160.0°0.0°
C14C13C18C170.0°0.6°
C13C14C15C20177.0°179.9°
C13C14C20C2195.8°49.7°
C13C14C20C2588.0°130.0°
C14C13N12H12160.7°24.6°
C13C14C15H151180.0°179.9°
C14C13C18H181180.0°179.7°
C15C16C17C180.0°0.4°
C15C16C17F19177.7°180.0°
C16C15C14H151180.0°180.0°
C16C15C14C20177.0°179.9°
C15C16C17H171180.0°180.0°
C18C17C16H171180.0°179.7°
C18C17C16F19177.8°179.7°
C17C18C13H181180.0°179.7°
C17C16C15C140.0°0.0°
C16C17C18C130.0°0.6°
C17C16C15H151180.0°179.9°
C16C17C18H181180.0°179.7°
F19C16C15C14177.7°180.0°
F19C16C15H1512.3°0.0°
F19C16C17H1712.3°0.0°
C15C14C20C2187.2°130.2°
C15C14C13C180.0°0.3°
C15C14C20C2588.9°50.1°
C14C20C21C25176.2°179.7°
C14C20C21C22176.1°180.0°
C14C20C25C24176.1°179.8°
C20C14C13C18177.0°179.8°
C20C14C15H1513.0°0.0°
C14C20C21H2113.9°0.1°
C14C20C25H2513.9°0.0°
C20C21C22H211180.0°179.9°
C21C20C25C240.0°0.6°
C20C21C22C230.1°0.0°
C20C21C22CL27177.7°180.0°
C21C20C25H251180.0°179.7°
C21C22C23C240.1°0.1°
C21C22C23CL26179.4°180.0°
C21C22C23CL27177.8°180.0°
C22C21C20C250.1°0.3°
C25C24C23H241180.0°179.8°
C25C24C23CL26179.4°179.8°
C25C24C23C220.0°0.2°
C24C25C20H251180.0°179.7°
C24C23CL26C22179.4°180.0°
C24C23C22CL27177.7°180.0°
C23C24C25C200.0°0.5°
C23C24C25H251180.0°179.8°
CL26C23C22CL272.8°0.0°
CL26C23C24H2410.6°0.0°
C23C22C21H211179.9°179.9°
C22C23C24H241180.0°180.0°
CL27C22C21H2112.3°0.0°
N06N02C01H0110.0°89.9°
N06N02C01H012120.0°150.0°
N06N02C01H013120.0°30.1°
N06N02C03H031180.0°179.7°
C18C13N12H121114.4°155.1°
C13C18C17H171180.0°179.7°
C25C20C21H211179.9°179.8°
C20C25C24H241180.0°179.7°
H011C01H012H013120.0°120.0°
H171C17C18H1810.0°0.0°
H241C24C25H2510.0°0.0°

249697

PDB entries from 2026-02-25

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