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WZX

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C14C13doub1.38Å1.38ÅAromatic
C14C15sing1.38Å1.38ÅAromatic
C13C12sing1.38Å1.39ÅAromatic
C15C16doub1.38Å1.39ÅAromatic
C12N11sing1.40Å1.33Å
C12C17doub1.39Å1.40ÅAromatic
C16C17sing1.39Å1.38ÅAromatic
N11C09sing1.35Å1.32Å
C17N07sing1.40Å1.42Å
C09O10doub1.21Å1.22Å
C09C08sing1.51Å1.49Å
O05C04doub1.21Å1.21Å
N07C08sing1.47Å1.45Å
N07C06sing1.47Å1.47Å
C04C06sing1.51Å1.49Å
C04O03sing1.34Å1.44Å
O03C02sing1.45Å1.43Å
C02C01sing1.53Å1.52Å
C13H1sing1.08Å1.08Å
C15H2sing1.08Å1.08Å
C01H3sing1.09Å1.10Å
C01H4sing1.09Å1.10Å
C01H5sing1.09Å1.10Å
C02H6sing1.09Å1.10Å
C02H7sing1.09Å1.10Å
C06H8sing1.09Å1.10Å
C06H9sing1.09Å1.10Å
C08H10sing1.09Å1.10Å
C08H11sing1.09Å1.10Å
N11H12sing0.97Å1.00Å
C14H13sing1.08Å1.08Å
C16H14sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C13C14C15118.8°120.1°
C14C13C12119.8°119.9°
C14C13H1120.1°120.1°
C13C14H13120.6°119.9°
C14C15C16122.1°120.3°
C14C15H2118.9°119.8°
C15C14H13120.6°120.0°
C13C12N11117.8°120.4°
C13C12C17121.4°120.1°
C12C13H1120.1°120.0°
C15C16C17119.8°120.0°
C16C15H2119.0°119.9°
C15C16H14120.1°120.0°
N11C12C17120.8°119.5°
C12N11C09121.5°118.6°
C12N11H12119.2°120.7°
C12C17C16118.0°119.7°
C12C17N07120.0°120.2°
C16C17N07122.0°120.2°
C17C16H14120.1°120.0°
N11C09O10117.8°120.3°
N11C09C08125.3°119.4°
C09N11H12119.2°120.7°
C17N07C08121.2°112.0°
C17N07C06124.6°111.0°
O10C09C08116.9°120.3°
C09C08N07111.3°110.0°
C09C08H10109.0°109.4°
C09C08H11109.0°109.3°
O05C04C06121.8°120.0°
O05C04O03121.7°120.0°
C08N07C06114.2°111.0°
N07C08H10109.0°109.4°
N07C08H11109.0°109.4°
N07C06C04115.2°109.4°
N07C06H8108.0°109.5°
N07C06H9108.0°109.4°
C06C04O03116.5°120.0°
C04C06H8108.0°109.5°
C04C06H9108.0°109.5°
C04O03C02120.6°117.0°
O03C02C01108.9°109.5°
O03C02H6109.6°109.4°
O03C02H7109.6°109.5°
C02C01H3109.5°109.5°
C02C01H4109.4°109.5°
C02C01H5109.5°109.4°
C01C02H6109.6°109.5°
C01C02H7109.6°109.5°
H3C01H4109.5°109.5°
H3C01H5109.4°109.5°
H4C01H5109.5°109.4°
H6C02H7109.4°109.5°
H8C06H9109.5°109.5°
H10C08H11109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C13C14C15H13180.0°179.9°
C14C13C12H1180.0°179.6°
C13C14C15C160.5°0.0°
C14C13C12N11179.5°179.5°
C14C13C12C172.1°0.4°
C13C14C15H2179.4°179.7°
C15C14C13C121.2°0.0°
C14C15C16H2180.0°179.7°
C14C15C16C171.4°0.2°
C15C14C13H1178.8°179.7°
C14C15C16H14178.6°179.7°
C13C12N11C17178.4°179.9°
C13C12C17C161.2°0.6°
C13C12N11C09179.7°161.8°
C13C12C17N07179.5°179.8°
C13C12N11H120.4°18.2°
C12C13C14H13178.8°179.9°
C15C16C17C120.5°0.6°
C15C16C17H14180.0°179.9°
C15C16C17N07177.8°179.9°
C16C15C14H13179.5°179.9°
N11C12C17C16179.6°179.2°
C12N11C09H12180.0°180.0°
N11C12C17N072.1°0.3°
C12N11C09O10178.7°179.2°
C12N11C09C080.2°0.8°
N11C12C13H10.5°0.1°
C12C17C16N07178.3°179.6°
C17C12N11C091.9°18.0°
C12C17N07C080.6°35.7°
C12C17N07C06178.2°160.4°
C17C12C13H1177.9°180.0°
C17C12N11H12178.1°162.0°
C12C17C16H14179.5°179.3°
C16C17N07C08178.9°143.8°
C16C17N07C063.5°19.2°
C17C16C15H2178.6°180.0°
N11C09O10C08178.6°180.0°
N11C09C08N071.1°34.9°
N11C09C08H10121.4°85.2°
N11C09C08H11119.2°155.1°
C17N07C08C090.8°50.6°
C17N07C08C06177.8°124.6°
C17N07C06C0489.8°63.8°
C17N07C06H831.1°176.2°
C17N07C06H9149.4°56.2°
C17N07C08H10121.1°69.6°
C17N07C08H11119.4°170.7°
N07C17C16H142.2°0.2°
O10C09C08N07177.3°145.1°
O10C09C08H1057.1°94.7°
O10C09C08H1162.4°25.0°
O10C09N11H121.3°0.8°
C09C08N07H10120.3°120.2°
C09C08N07H11120.3°120.1°
C09C08N07C06177.0°175.3°
C09C08H10H11119.2°119.7°
C08C09N11H12179.7°179.2°
O05C04C06N0713.3°6.2°
O05C04C06O03178.5°180.0°
O05C04O03C0212.0°0.0°
O05C04C06H8107.5°126.2°
O05C04C06H9134.1°113.7°
C08N07C06C0492.5°61.4°
C08N07C06H8146.7°58.6°
C08N07C06H928.4°178.6°
N07C08H10H11119.2°119.7°
N07C06C04H8120.8°120.0°
N07C06C04H9120.8°119.9°
N07C06C04O03168.3°173.8°
N07C06H8H9117.4°120.0°
C06N07C08H1056.7°55.0°
C06N07C08H1162.7°64.7°
C06C04O03C02169.6°180.0°
C04C06H8H9117.4°120.1°
C04O03C02C01165.5°180.0°
C04O03C02H674.6°60.0°
C04O03C02H745.6°60.0°
O03C04C06H870.9°53.8°
O03C04C06H947.4°66.3°
O03C02C01H6119.9°120.0°
O03C02C01H7119.9°120.0°
O03C02C01H3180.0°60.0°
O03C02C01H460.0°60.0°
O03C02C01H560.0°180.0°
O03C02H6H7120.3°120.0°
C02C01H3H4120.0°120.0°
C02C01H3H5120.0°120.0°
C02C01H4H5120.0°120.0°
C01C02H6H7120.3°120.0°
H1C13C14H131.2°0.4°
H2C15C14H130.6°0.4°
H2C15C16H141.4°0.1°
H3C01H4H5120.0°120.0°
H3C01C02H660.1°60.0°
H3C01C02H760.1°NaN°
H4C01C02H6179.9°180.0°
H4C01C02H759.9°60.0°
H5C01C02H659.9°60.0°
H5C01C02H7179.9°60.0°

227344

PDB entries from 2024-11-13

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