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SummaryGeometryRelated PDB entries

XMW

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C21C20doub1.39Å1.36ÅAromatic
C21C22sing1.38Å1.35ÅAromatic
C20C19sing1.38Å1.39ÅAromatic
C22C17doub1.39Å1.38ÅAromatic
C19N18doub1.32Å1.35ÅAromatic
C17N18sing1.33Å1.35ÅAromatic
C17C16sing1.48Å1.52Å
C16C23doub1.35Å1.44ÅAromatic
C16N15sing1.33Å1.53ÅAromatic
C23S24sing1.76Å1.64ÅAromatic
N15C01doub1.30Å1.41ÅAromatic
C01S24sing1.76Å1.66ÅAromatic
C01N02sing1.39Å1.44Å
N02C03sing1.38Å1.44Å
S14C03sing1.75Å1.73ÅAromatic
S14C06sing1.76Å1.70ÅAromatic
C03N04doub1.29Å1.38ÅAromatic
C06C07doub1.40Å1.38ÅAromatic
C06C05sing1.40Å1.41ÅAromatic
N04C05sing1.35Å1.44ÅAromatic
C07C08sing1.38Å1.52ÅAromatic
C05C13doub1.41Å1.38ÅAromatic
C08O09sing1.37Å1.41Å
C08C12doub1.40Å1.32ÅAromatic
C13C12sing1.38Å1.52ÅAromatic
O09C10sing1.44Å1.39Å
C12O11sing1.37Å1.39Å
O11C10sing1.44Å1.38Å
C10H102sing1.09Å1.10Å
C10H101sing1.09Å1.10Å
C13H131sing1.08Å1.08Å
C20H201sing1.08Å1.08Å
C21H211sing1.08Å1.08Å
C22H221sing1.08Å1.08Å
C07H071sing1.08Å1.08Å
C19H191sing1.08Å1.08Å
C23H231sing1.08Å1.08Å
N02H021sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C20C21C22119.6°118.5°
C21C20C19120.1°119.4°
C21C20H201119.9°120.3°
C20C21H211120.2°120.7°
C21C22C17120.0°119.1°
C22C21H211120.2°120.7°
C21C22H221120.0°120.5°
C20C19N18120.1°120.9°
C19C20H201119.9°120.3°
C20C19H191119.9°119.6°
C22C17N18120.4°120.5°
C22C17C16119.5°119.8°
C17C22H221120.0°120.4°
C19N18C17119.7°121.5°
N18C19H191119.9°119.5°
N18C17C16120.0°119.7°
C17C16C23126.3°122.4°
C17C16N15123.6°122.3°
C23C16N15110.1°115.3°
C16C23S24109.7°108.2°
C16C23H231125.2°125.8°
C16N15C01110.6°116.9°
C23S24C0199.5°90.1°
S24C23H231125.2°125.9°
N15C01S24110.1°109.5°
N15C01N02124.3°125.3°
S24C01N02125.6°125.2°
C01N02C03120.2°120.0°
C01N02H021119.9°120.0°
N02C03S14126.5°124.8°
N02C03N04123.5°124.8°
C03N02H021119.9°120.0°
C03S14C0695.1°90.6°
S14C03N04110.0°110.4°
S14C06C07132.3°131.1°
S14C06C05108.9°108.3°
C03N04C05112.2°117.9°
C07C06C05118.7°120.6°
C06C07C08119.4°120.1°
C06C07H071120.3°119.8°
C06C05N04113.7°112.8°
C06C05C13124.6°118.5°
N04C05C13121.7°128.7°
C07C08O09132.0°131.5°
C07C08C12120.3°119.9°
C08C07H071120.3°120.0°
C05C13C12116.6°120.6°
C05C13H131121.7°119.7°
O09C08C12107.7°108.6°
C08O09C10103.0°105.4°
C08C12C13120.4°120.3°
C08C12O11108.5°108.4°
C13C12O11131.0°131.3°
C12C13H131121.7°119.8°
O09C10O11104.7°103.9°
O09C10H102110.7°110.5°
O09C10H101110.6°110.6°
C12O11C10103.9°105.5°
O11C10H102110.7°110.6°
O11C10H101110.6°110.6°
H102C10H101109.5°110.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
C20C21C22H211180.0°179.7°
C21C20C19H201180.0°179.4°
C20C21C22C170.3°0.0°
C21C20C19N180.0°0.6°
C20C21C22H221179.7°180.0°
C21C20C19H191180.0°180.0°
C22C21C20C190.0°0.3°
C21C22C17H221180.0°180.0°
C21C22C17N180.6°0.0°
C21C22C17C16179.9°179.8°
C22C21C20H201180.0°179.7°
C20C19N18H191180.0°179.4°
C20C19N18C170.3°0.6°
C19C20C21H211180.0°180.0°
C22C17N18C190.6°0.3°
C22C17N18C16179.3°179.7°
C22C17C16C23146.3°179.7°
C22C17C16N1534.0°0.3°
C17C22C21H211179.7°179.7°
C19N18C17C16179.9°180.0°
N18C19C20H201180.0°180.0°
N18C17C16C2334.4°0.0°
N18C17C16N15145.3°179.5°
N18C17C22H221179.4°180.0°
C17N18C19H191179.8°180.0°
C17C16C23N15179.7°179.5°
C17C16C23S24179.7°180.0°
C17C16N15C01179.3°179.8°
C16C17C22H2210.1°0.3°
C17C16C23H2310.2°0.1°
C16C23S24H231180.0°179.9°
C23C16N15C010.4°0.3°
C16C23S24C010.4°0.4°
N15C16C23S240.0°0.5°
C16N15C01S240.7°0.0°
C16N15C01N02179.2°179.8°
N15C16C23H231179.9°179.4°
C23S24C01N150.6°0.3°
C23S24C01N02179.2°180.0°
N15C01S24N02178.5°179.7°
N15C01N02C0333.7°179.7°
N15C01N02H021146.3°0.2°
S24C01N02C03148.0°0.0°
C01S24C23H231179.6°179.5°
S24C01N02H02132.0°179.9°
C01N02C03H021180.0°179.9°
C01N02C03S1417.5°0.1°
C01N02C03N04163.0°179.9°
N02C03S14N04179.6°179.9°
N02C03S14C06179.7°179.9°
N02C03N04C05179.7°180.0°
C03S14C06C07179.6°179.9°
C03S14C06C050.1°0.0°
S14C03N04C050.1°0.1°
S14C03N02H021162.5°180.0°
C06S14C03N040.1°0.1°
S14C06C07C05179.8°179.9°
S14C06C05N040.1°0.0°
S14C06C07C08179.7°179.9°
S14C06C05C13179.9°180.0°
S14C06C07H0710.3°0.0°
C03N04C05C060.0°0.1°
C03N04C05C13179.8°180.0°
N04C03N02H02117.0°0.2°
C07C06C05N04179.7°180.0°
C06C07C08H071180.0°180.0°
C07C06C05C130.1°0.1°
C06C07C08O09179.6°179.9°
C06C07C08C120.2°0.1°
C06C05N04C13179.8°179.9°
C05C06C07C080.0°0.0°
C06C05C13C120.0°0.1°
C06C05C13H131180.0°180.0°
C05C06C07H071180.0°180.0°
N04C05C13C12179.7°180.0°
N04C05C13H1310.2°0.1°
C07C08O09C12179.4°180.0°
C07C08C12C130.3°0.1°
C07C08O09C10159.5°162.7°
C07C08C12O11180.0°180.0°
C05C13C12C080.2°0.0°
C05C13C12H131180.0°179.9°
C05C13C12O11179.9°179.9°
O09C08C12C13179.8°179.9°
O09C08C12O110.4°0.0°
C08O09C10O1133.5°27.3°
C08O09C10H102152.8°145.9°
C08O09C10H10185.7°91.4°
O09C08C07H0710.4°0.0°
C08C12C13O11179.7°179.9°
C12C08O09C1021.0°17.3°
C08C12O11C1020.5°17.3°
C08C12C13H131179.8°179.9°
C12C08C07H071179.8°179.9°
C13C12O11C10159.2°162.6°
O09C10O11C1233.5°27.3°
O09C10O11H102119.3°118.6°
O09C10O11H101119.2°118.7°
O09C10H102H101122.2°122.7°
C12O11C10H102152.8°145.9°
C12O11C10H10185.7°91.5°
O11C12C13H1310.1°0.1°
O11C10H102H101122.2°122.7°
H201C20C21H2110.0°0.6°
H201C20C19H1910.0°0.6°
H211C21C22H2210.3°0.3°

250359

PDB entries from 2026-03-11

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