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SummaryGeometryRelated PDB entries

A1D7A

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
O18C19sing1.43Å1.41Å
O18C16sing1.36Å1.46Å
C17C16doub1.39Å1.42ÅAromatic
C17C12sing1.39Å1.47ÅAromatic
C16C15sing1.39Å1.40ÅAromatic
C12N11sing1.40Å1.48Å
C12C13doub1.40Å1.38ÅAromatic
N11C09sing1.35Å1.49Å
C15C14doub1.38Å1.39ÅAromatic
O10C09doub1.21Å1.20Å
C09C08sing1.51Å1.56Å
C13C14sing1.38Å1.44ÅAromatic
C13N07sing1.40Å1.47Å
S23C22sing1.76Å1.83ÅAromatic
S23C01sing1.76Å1.71ÅAromatic
C22C21doub1.32Å1.39ÅAromatic
N07C08sing1.47Å1.44Å
N07C06sing1.39Å1.43Å
C01C06doub1.40Å1.35ÅAromatic
C01C02sing1.40Å1.45ÅAromatic
C06N05sing1.33Å1.34ÅAromatic
C21C02sing1.40Å1.43ÅAromatic
C02N03doub1.35Å1.32ÅAromatic
N05C04doub1.32Å1.33ÅAromatic
N03C04sing1.31Å1.36ÅAromatic
C04CL20sing1.74Å1.83Å
C15H151sing1.08Å1.08Å
C17H171sing1.08Å1.08Å
C21H211sing1.08Å1.08Å
C22H221sing1.08Å1.08Å
C08H081sing1.09Å1.10Å
C08H082sing1.09Å1.10Å
C14H141sing1.08Å1.08Å
C19H193sing1.09Å1.10Å
C19H191sing1.09Å1.10Å
C19H192sing1.09Å1.10Å
N11H111sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C19O18C16111.1°117.0°
O18C19H193109.5°109.5°
O18C19H191109.4°109.5°
O18C19H192109.5°109.5°
O18C16C17126.8°119.9°
O18C16C15117.0°119.8°
C16C17C12121.5°119.8°
C17C16C15116.3°120.3°
C16C17H171119.3°120.1°
C17C12N11125.8°120.7°
C17C12C13121.6°119.7°
C12C17H171119.2°120.1°
C16C15C14121.4°120.1°
C16C15H151119.3°120.0°
N11C12C13112.6°119.5°
C12N11C09126.0°120.8°
C12N11H111117.0°119.6°
C12C13C14114.7°120.3°
C12C13N07123.2°118.7°
N11C09O10119.7°119.6°
N11C09C08119.7°120.8°
C09N11H111117.0°119.7°
C15C14C13124.6°119.8°
C14C15H151119.3°119.9°
C15C14H141117.7°120.1°
O10C09C08120.5°119.6°
C09C08N07108.5°109.0°
C09C08H081109.7°109.5°
C09C08H082109.7°109.6°
C14C13N07122.1°121.1°
C13C14H141117.7°120.1°
C13N07C08128.3°117.9°
C13N07C06115.7°121.1°
C22S23C0196.3°91.5°
S23C22C21106.2°110.8°
S23C22H221126.9°124.6°
S23C01C06136.2°131.6°
S23C01C02106.7°109.5°
C22C21C02114.7°115.8°
C22C21H211122.7°122.1°
C21C22H221126.9°124.7°
C08N07C06108.7°121.1°
N07C08H081109.7°109.6°
N07C08H082109.7°109.5°
N07C06C01122.5°120.5°
N07C06N05115.6°120.6°
C06C01C02117.1°118.9°
C01C06N05121.8°118.9°
C01C02C21116.0°112.5°
C01C02N03120.0°117.8°
C06N05C04119.1°120.7°
C21C02N03124.0°129.7°
C02C21H211122.6°122.1°
C02N03C04119.3°121.1°
N05C04N03122.8°122.6°
N05C04CL20117.3°118.7°
N03C04CL20119.9°118.7°
H081C08H082109.5°109.6°
H193C19H191109.5°109.5°
H193C19H192109.4°109.5°
H191C19H192109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
C19O18C16C17171.7°180.0°
C19O18C16C157.0°0.3°
O18C19H193H191120.0°120.0°
O18C19H193H192120.0°120.1°
O18C19H191H192120.0°120.0°
O18C16C17C15178.7°179.7°
O18C16C17C12178.5°180.0°
O18C16C15C14177.5°179.8°
O18C16C15H1512.5°0.2°
O18C16C17H1711.6°0.3°
C16O18C19H193180.0°60.0°
C16O18C19H19160.0°60.0°
C16O18C19H19260.0°180.0°
C16C17C12H171180.0°179.7°
C16C17C12N11179.9°179.5°
C16C17C12C130.3°0.3°
C17C16C15C141.3°0.1°
C17C16C15H151178.6°179.9°
C12C17C16C150.2°0.2°
C17C12N11C13179.6°179.8°
C17C12N11C09174.6°166.0°
C17C12C13C140.2°0.3°
C17C12C13N07179.4°179.5°
C17C12N11H1115.4°14.0°
C16C15C14H151180.0°180.0°
C16C15C14C132.0°0.0°
C15C16C17H171179.8°179.9°
C16C15C14H141178.0°179.9°
C12N11C09H111180.0°180.0°
C12N11C09O10174.2°177.5°
C12N11C09C080.9°2.5°
N11C12C13C14179.4°179.5°
N11C12C13N071.0°0.7°
N11C12C17H1710.2°0.2°
C13C12N11C095.0°14.2°
C12C13C14C151.4°0.1°
C12C13C14N07179.6°179.8°
C12C13N07C0813.0°29.2°
C12C13N07C06133.3°150.8°
C13C12C17H171179.7°180.0°
C12C13C14H141178.6°180.0°
C13C12N11H111175.0°165.8°
N11C09O10C08175.0°180.0°
N11C09C08N078.6°29.1°
N11C09C08H081128.4°90.8°
N11C09C08H082111.3°149.0°
C15C14C13H141180.0°179.9°
C15C14C13N07178.2°179.7°
O10C09C08N07176.4°150.8°
O10C09C08H08156.6°89.2°
O10C09C08H08263.8°31.0°
O10C09N11H1115.8°2.5°
C09C08N07C1315.7°42.0°
C09C08N07H081119.8°119.9°
C09C08N07H082119.9°119.9°
C09C08N07C06132.5°138.0°
C09C08H081H082120.5°120.2°
C08C09N11H111179.1°177.5°
C14C13N07C08167.4°150.6°
C14C13N07C0646.2°29.4°
C13C14C15H151178.0°180.0°
C13N07C08C06148.2°180.0°
C13N07C06C0123.9°172.3°
C13N07C06N05151.9°7.6°
C13N07C08H081135.5°77.9°
C13N07C08H082104.2°161.9°
N07C13C14H1411.8°0.2°
S23C22C21H221180.0°180.0°
C22S23C01C06177.8°179.9°
C22S23C01C020.4°0.3°
S23C22C21C020.5°0.0°
S23C22C21H211179.5°179.7°
C01S23C22C210.6°0.2°
S23C01C06N074.4°0.4°
S23C01C06C02177.2°179.6°
S23C01C06N05179.9°179.5°
S23C01C02C210.2°0.3°
S23C01C02N03179.7°179.6°
C01S23C22H221179.4°179.9°
C22C21C02C010.2°0.2°
C22C21C02H211180.0°179.7°
C22C21C02N03179.9°179.7°
C08N07C06C01128.8°7.7°
C08N07C06N0555.4°172.4°
N07C08H081H082120.4°120.2°
N07C06C01N05175.5°179.9°
N07C06C01C02178.4°180.0°
N07C06N05C04178.7°180.0°
C06N07C08H08112.7°102.1°
C06N07C08H082107.6°18.1°
C06C01C02C21178.2°180.0°
C06C01C02N031.7°0.1°
C01C06N05C042.8°0.1°
C02C01C06N052.9°0.1°
C01C02C21N03179.9°179.9°
C01C02N03C040.5°0.1°
C01C02C21H211179.8°179.9°
C06N05C04N031.5°0.1°
C06N05C04CL20177.9°180.0°
C21C02N03C04179.4°180.0°
C02C21C22H221179.5°180.0°
C02N03C04N050.4°0.1°
C02N03C04CL20179.1°180.0°
N03C02C21H2110.1°0.0°
N05C04N03CL20179.4°179.9°
H151C15C14H1412.0°0.1°
H211C21C22H2210.5°0.3°
H193C19H191H192120.0°119.9°

250059

PDB entries from 2026-03-04

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