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QXL

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
S02O01doub1.42Å1.46Å
C04C03sing1.53Å1.52Å
C05C04sing1.53Å1.62Å
C06C05sing1.53Å1.61Å
C08N07sing1.38Å1.45Å
C09C08doub1.40Å1.42ÅAromatic
C10C09sing1.46Å1.41ÅAromatic
C11C10doub1.34Å1.39ÅAromatic
N12C11sing1.37Å1.33ÅAromatic
C13N12sing1.37Å1.36ÅAromatic
N14C13doub1.33Å1.35ÅAromatic
C15N14sing1.32Å1.32ÅAromatic
N16C15doub1.32Å1.33ÅAromatic
N07C06sing1.46Å1.43Å
C17C06sing1.53Å1.52Å
C03S02sing1.82Å1.71Å
O18S02doub1.42Å1.46Å
S02C17sing1.82Å1.73Å
C08N16sing1.33Å1.33ÅAromatic
C09C13sing1.41Å1.37ÅAromatic
C17H172sing1.09Å1.10Å
C17H171sing1.09Å1.10Å
C15H151sing1.08Å1.08Å
C11H111sing1.08Å1.08Å
C10H101sing1.08Å1.08Å
C03H032sing1.09Å1.10Å
C03H031sing1.09Å1.10Å
C04H041sing1.09Å1.10Å
C04H042sing1.09Å1.10Å
C05H052sing1.09Å1.10Å
C05H051sing1.09Å1.10Å
C06H061sing1.09Å1.10Å
N07H071sing0.97Å1.00Å
N12H121sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O01S02C03107.1°108.6°
O01S02O18119.4°119.4°
O01S02C17108.2°108.7°
C03C04C05115.4°110.0°
C04C03S02113.8°109.0°
C04C03H032108.4°109.6°
C04C03H031108.4°109.6°
C03C04H041108.0°109.4°
C03C04H042108.0°109.4°
C04C05C06114.8°110.7°
C05C04H041107.9°109.3°
C05C04H042107.9°109.3°
C04C05H052108.1°109.3°
C04C05H051108.1°109.3°
C05C06N07109.9°109.4°
C05C06C17113.2°110.0°
C06C05H052108.1°109.3°
C06C05H051108.1°109.2°
C05C06H061107.5°109.4°
N07C08C09116.8°120.8°
C08N07C06122.7°120.0°
N07C08N16122.3°120.8°
C08N07H071106.1°120.0°
C08C09C10136.6°135.2°
C09C08N16120.9°118.4°
C08C09C13117.8°118.6°
C09C10C11107.7°106.8°
C10C09C13105.7°106.2°
C09C10H101126.1°126.6°
C10C11N12107.8°109.8°
C10C11H111126.1°125.1°
C11C10H101126.2°126.6°
C11N12C13110.0°110.0°
N12C11H111126.1°125.1°
C11N12H121125.0°125.0°
N12C13N14132.8°134.2°
N12C13C09108.9°107.2°
C13N12H121125.0°125.1°
C13N14C15122.4°120.7°
N14C13C09118.3°118.6°
N14C15N16121.5°122.7°
N14C15H151119.2°118.6°
C15N16C08119.1°121.0°
N16C15H151119.3°118.7°
N07C06C17107.9°109.4°
N07C06H061109.8°109.3°
C06N07H071106.1°120.0°
C06C17S02114.6°109.0°
C06C17H172108.2°109.5°
C06C17H171108.1°109.6°
C17C06H061108.5°109.4°
C03S02O18110.7°108.6°
C03S02C17100.6°101.3°
S02C03H032108.4°109.5°
S02C03H031108.4°109.5°
O18S02C17109.2°108.7°
S02C17H172108.2°109.5°
S02C17H171108.2°109.6°
H172C17H171109.5°109.6°
H032C03H031109.5°109.6°
H041C04H042109.5°109.4°
H052C05H051109.5°109.2°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O01S02C03C04172.3°60.0°
O01S02C17C06173.6°60.0°
O01S02C03O18131.7°131.3°
O01S02C03C17112.9°114.3°
O01S02O18C17125.2°125.3°
O01S02C17H17252.9°59.8°
O01S02C17H17165.6°179.9°
O01S02C03H03267.1°179.9°
O01S02C03H03151.7°59.9°
C03C04C05H041120.9°120.2°
C03C04C05H042120.9°120.1°
C03C04C05C0640.0°70.0°
C04C03S02H032120.6°119.9°
C04C03S02H031120.6°119.9°
C04C03S02O1856.0°168.7°
C04C03S02C1759.4°54.3°
C04C03H032H031118.0°120.3°
C03C04H041H042117.3°119.8°
C03C04C05H05280.7°169.7°
C03C04C05H051160.8°50.3°
C04C05C06H052120.8°120.4°
C04C05C06H051120.8°120.3°
C04C05C06N0780.2°169.9°
C04C05C06C1740.5°70.0°
C05C04C03S0253.1°63.7°
C05C04C03H032173.8°56.2°
C05C04C03H03167.5°176.5°
C05C04H041H042117.3°119.7°
C04C05H052H051117.6°119.5°
C04C05C06H061160.3°50.2°
C05C06N07C0880.2°84.4°
C05C06N07C17123.8°120.5°
C05C06N07H061118.0°119.7°
C05C06C17H061119.2°120.1°
C05C06C17S0255.1°63.7°
C05C06C17H17265.6°176.5°
C05C06C17H171175.9°56.3°
C06C05C04H041160.9°50.2°
C06C05C04H04280.8°169.9°
C06C05H052H051117.6°119.3°
C05C06N07H071158.0°95.5°
N07C08C09N16179.7°179.4°
N07C08C09C100.2°0.1°
N07C08N16C15179.7°179.9°
C08N07C06H071121.8°179.9°
C08N07C06C17156.0°155.1°
N07C08C09C13179.8°179.8°
C08N07C06H06137.9°35.3°
C08C09C10C13180.0°179.8°
C08C09C10C11180.0°179.3°
C08C09C13N12180.0°179.5°
C08C09C13N140.1°0.5°
C09C08N16C150.1°0.5°
C09C08N07C06175.9°179.5°
C08C09C10H1010.0°0.7°
C09C08N07H07154.1°0.6°
C09C10C11H101180.0°180.0°
C09C10C11N120.1°0.5°
C10C09C13N120.0°0.3°
C10C09C13N14179.9°179.7°
C10C09C08N16179.9°179.5°
C09C10C11H111179.9°180.0°
C10C11N12H111180.0°179.5°
C10C11N12C130.1°0.3°
C11C10C09C130.1°0.5°
C10C11N12H121179.9°179.7°
C11N12C13H121180.0°180.0°
C11N12C13N14179.8°180.0°
C11N12C13C090.1°0.0°
N12C11C10H101179.9°179.5°
N12C13N14C09179.9°180.0°
N12C13N14C15179.7°180.0°
C13N12C11H111179.9°179.9°
C13N14C15N160.5°0.3°
C13N14C15H151179.5°180.0°
N14C13N12H1210.2°0.1°
N14C15N16H151180.0°179.7°
N14C15N16C080.2°0.0°
C15N14C13C090.4°0.0°
N07C06C17H061119.0°119.7°
N07C06C17S0266.7°176.2°
C06N07C08N164.4°0.1°
N07C06C17H172172.6°56.4°
N07C06C17H17154.1°63.8°
N07C06C05H052159.0°49.5°
N07C06C05H05140.6°69.8°
C06C17S02C0361.5°54.3°
C06C17S02O1854.9°168.6°
C06C17S02H172120.8°119.8°
C06C17S02H171120.7°119.9°
C06C17H172H171117.6°120.2°
C17C06C05H05280.3°169.7°
C17C06C05H051161.3°50.3°
C17C06N07H07134.2°25.0°
C03S02O18C17109.9°109.4°
C03S02C17H17259.2°174.1°
C03S02C17H171177.7°65.6°
S02C03H032H031118.1°120.1°
S02C03C04H041174.0°56.5°
S02C03C04H04267.7°176.3°
O18S02C17H172175.7°71.6°
O18S02C17H17165.8°48.7°
O18S02C03H03264.6°48.7°
O18S02C03H031176.7°71.4°
S02C17H172H171117.7°120.3°
C17S02C03H032180.0°65.6°
C17S02C03H03161.2°174.2°
S02C17C06H061174.3°56.5°
N16C08C09C130.1°0.8°
C08N16C15H151179.8°179.7°
N16C08N07H071126.3°180.0°
C13C09C10H101180.0°179.5°
C09C13N12H121180.0°180.0°
H172C17C06H06153.6°63.3°
H171C17C06H06164.9°176.4°
H111C11C10H1010.1°0.0°
H111C11N12H1210.1°0.2°
H032C03C04H04165.4°176.3°
H032C03C04H04252.9°63.8°
H031C03C04H04153.4°63.4°
H031C03C04H042171.7°56.5°
H041C04C05H05240.1°70.1°
H041C04C05H05178.3°170.4°
H042C04C05H052158.4°49.6°
H042C04C05H05140.0°69.8°
H052C05C06H06139.5°70.2°
H051C05C06H06178.9°170.5°
H061C06N07H07184.0°144.8°

222415

PDB entries from 2024-07-10

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