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SummaryGeometryRelated PDB entries

TJ3

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
O21C19doub1.21Å1.21Å
N12C19sing1.34Å1.34Å
N12C18sing1.40Å1.40Å
C19C20sing1.51Å1.51Å
C18C15doub1.39Å1.40ÅAromatic
C18C17sing1.39Å1.40ÅAromatic
C15C14sing1.38Å1.39ÅAromatic
C20C17sing1.51Å1.51Å
C17C16doub1.38Å1.38ÅAromatic
C25C24sing1.51Å1.51Å
C14C13doub1.39Å1.40ÅAromatic
C10C24doub1.35Å1.36ÅAromatic
C10C9sing1.40Å1.40ÅAromatic
C16C13sing1.39Å1.40ÅAromatic
C24N8sing1.36Å1.37ÅAromatic
C13N11sing1.40Å1.41Å
C9C23sing1.51Å1.51Å
C9N22doub1.31Å1.30ÅAromatic
N11C5sing1.39Å1.39Å
N6C5doub1.33Å1.34ÅAromatic
N6C7sing1.32Å1.33ÅAromatic
N8C7sing1.40Å1.40Å
N8N22sing1.40Å1.40ÅAromatic
C5C4sing1.40Å1.41ÅAromatic
C7N2doub1.32Å1.33ÅAromatic
N2C3sing1.32Å1.33ÅAromatic
C4C3doub1.38Å1.38ÅAromatic
C4CL1sing1.74Å1.74Å
C10H1sing1.08Å1.08Å
N12H2sing0.97Å1.00Å
C15H3sing1.08Å1.08Å
C20H4sing1.09Å1.10Å
C20H5sing1.09Å1.10Å
C16H6sing1.08Å1.08Å
C25H7sing1.09Å1.10Å
C25H8sing1.09Å1.10Å
C25H9sing1.09Å1.10Å
C14H10sing1.08Å1.08Å
N11H11sing0.97Å1.00Å
C3H12sing1.08Å1.08Å
C23H13sing1.09Å1.10Å
C23H14sing1.09Å1.10Å
C23H15sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
O21C19N12126.2°126.4°
O21C19C20126.0°126.5°
C19N12C18111.8°112.2°
N12C19C20107.7°107.1°
C19N12H2124.1°123.9°
N12C18C15130.5°130.8°
N12C18C17110.2°110.2°
C18N12H2124.1°123.9°
C19C20C17103.8°104.1°
C19C20H4110.8°110.5°
C19C20H5110.9°110.6°
C15C18C17119.3°119.1°
C18C15C14119.7°120.3°
C18C15H3120.1°119.9°
C18C17C20106.4°106.4°
C18C17C16121.1°120.9°
C15C14C13120.7°120.2°
C14C15H3120.2°119.9°
C15C14H10119.6°119.8°
C20C17C16132.5°132.8°
C17C20H4110.9°110.5°
C17C20H5110.9°110.5°
C17C16C13119.7°119.8°
C17C16H6120.1°120.1°
C25C24C10125.0°126.1°
C25C24N8127.4°126.2°
C24C25H7109.5°109.5°
C24C25H8109.4°109.4°
C24C25H9109.5°109.5°
C14C13C16119.4°119.7°
C14C13N11121.3°120.1°
C13C14H10119.6°119.9°
C24C10C9108.0°107.9°
C10C24N8107.6°107.6°
C24C10H1126.0°126.0°
C10C9C23126.9°125.8°
C10C9N22108.1°108.4°
C9C10H1126.0°126.0°
C16C13N11119.2°120.1°
C13C16H6120.1°120.1°
C24N8C7128.4°126.1°
C24N8N22107.2°107.8°
C13N11C5123.8°120.0°
C13N11H11118.1°120.0°
C23C9N22125.0°125.8°
C9C23H13109.5°109.5°
C9C23H14109.4°109.5°
C9C23H15109.4°109.4°
C9N22N8109.2°108.2°
N11C5N6121.6°120.5°
N11C5C4119.7°120.5°
C5N11H11118.1°120.0°
C5N6C7121.0°120.6°
N6C5C4118.7°119.0°
N6C7N8121.8°119.1°
N6C7N2120.8°121.7°
C7N8N22124.3°126.1°
N8C7N2117.4°119.2°
C5C4C3118.2°118.4°
C5C4CL1123.1°120.8°
C7N2C3121.8°121.0°
N2C3C4119.5°119.3°
N2C3H12120.2°120.4°
C3C4CL1118.6°120.8°
C4C3H12120.2°120.4°
H4C20H5109.5°110.4°
H7C25H8109.5°109.5°
H7C25H9109.5°109.5°
H8C25H9109.5°109.4°
H13C23H14109.5°109.5°
H13C23H15109.5°109.4°
H14C23H15109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
O21C19N12C20176.6°179.9°
O21C19N12C18179.5°180.0°
O21C19C20C17178.7°180.0°
O21C19N12H20.4°0.3°
O21C19C20H459.6°61.3°
O21C19C20H562.2°61.3°
C19N12C18H2180.0°179.6°
C19N12C18C15179.3°179.9°
C19N12C18C172.7°0.1°
N12C19C20C172.1°0.1°
N12C19C20H4117.0°118.6°
N12C19C20H5121.2°118.8°
C18N12C19C203.0°0.1°
N12C18C15C17177.8°180.0°
N12C18C15C14179.0°180.0°
N12C18C17C201.2°0.0°
N12C18C17C16179.9°179.9°
N12C18C15H31.0°0.0°
C19C20C17C180.5°0.1°
C19C20C17H4119.1°118.7°
C19C20C17H5119.1°118.8°
C19C20C17C16178.0°180.0°
C20C19N12H2177.0°179.7°
C19C20H4H5122.6°122.7°
C18C15C14H3180.0°180.0°
C15C18C17C20179.4°180.0°
C15C18C17C161.9°0.1°
C18C15C14C131.1°0.0°
C15C18N12H20.7°0.3°
C18C15C14H10178.9°180.0°
C17C18C15C141.2°0.0°
C18C17C20C16178.5°179.9°
C18C17C16C130.3°0.0°
C17C18N12H2177.2°179.7°
C17C18C15H3178.8°180.0°
C18C17C20H4118.6°118.6°
C18C17C20H5119.6°118.8°
C18C17C16H6179.7°180.0°
C15C14C13H10180.0°179.9°
C15C14C13C162.7°0.1°
C15C14C13N11179.3°180.0°
C20C17C16C13178.6°179.9°
C17C20H4H5122.6°122.6°
C20C17C16H61.4°0.1°
C17C16C13C142.0°0.1°
C17C16C13H6180.0°180.0°
C17C16C13N11178.6°180.0°
C16C17C20H462.9°61.3°
C16C17C20H558.9°61.3°
C25C24C10N8178.8°179.9°
C25C24C10C9179.5°180.0°
C25C24N8C72.1°0.1°
C25C24N8N22179.4°180.0°
C25C24C10H10.5°0.3°
C24C25H7H8120.0°120.0°
C24C25H7H9120.0°120.1°
C24C25H8H9120.0°120.0°
C14C13C16N11176.7°179.9°
C14C13N11C557.0°32.9°
C13C14C15H3178.9°179.9°
C14C13C16H6178.1°179.9°
C14C13N11H11122.9°147.1°
C24C10C9H1180.0°179.7°
C24C10C9C23179.6°180.0°
C24C10C9N220.5°0.0°
C10C24N8C7176.7°180.0°
C10C24N8N220.6°0.1°
C10C24C25H790.7°90.1°
C10C24C25H8149.3°149.9°
C10C24C25H929.3°30.0°
C9C10C24N80.7°0.0°
C10C9C23N22179.0°180.0°
C10C9N22N80.1°0.0°
C10C9C23H13179.0°89.9°
C10C9C23H1461.0°150.0°
C10C9C23H1559.0°30.0°
C16C13N11C5126.3°147.2°
C16C13C14H10177.3°180.0°
C16C13N11H1153.7°32.9°
C24N8N22C90.3°0.1°
C24N8C7N635.9°179.5°
C24N8C7N22176.8°179.9°
C24N8C7N2144.2°0.1°
N8C24C10H1179.4°179.8°
N8C24C25H790.8°90.0°
N8C24C25H829.2°30.0°
N8C24C25H9149.2°149.9°
C13N11C5H11180.0°180.0°
C13N11C5N61.4°5.6°
C13N11C5C4179.9°174.4°
N11C13C16H61.4°0.0°
N11C13C14H100.7°0.1°
C23C9N22N8179.2°180.0°
C23C9C10H10.4°0.2°
C9C23H13H14120.0°120.0°
C9C23H13H15120.0°120.0°
C9C23H14H15120.0°120.0°
C9N22N8C7177.1°180.0°
N22C9C10H1179.6°179.7°
N22C9C23H130.0°90.1°
N22C9C23H14120.0°30.0°
N22C9C23H15120.0°149.9°
N11C5N6C4178.5°180.0°
N11C5N6C7177.0°180.0°
N11C5C4C3177.0°180.0°
N11C5C4CL10.7°0.3°
C5N6C7N8179.3°179.8°
C5N6C7N20.9°0.2°
N6C5C4C31.6°0.1°
N6C5C4CL1177.8°179.7°
N6C5N11H11178.5°174.5°
N6C7N8N2179.8°179.6°
N6C7N8N22147.2°0.5°
C7N6C5C41.5°0.0°
N6C7N2C30.4°0.5°
N8C7N2C3179.8°180.0°
N22N8C7N232.6°180.0°
C5C4C3N21.1°0.3°
C5C4C3CL1176.4°179.6°
C4C5N11H110.0°5.6°
C5C4C3H12178.9°179.8°
C7N2C3C40.5°0.5°
C7N2C3H12179.5°179.6°
N2C3C4H12180.0°179.9°
N2C3C4CL1177.5°180.0°
CL1C4C3H122.5°0.1°
H3C15C14H101.0°0.0°
H7C25H8H9120.0°120.0°
H13C23H14H15120.0°120.0°

249697

PDB entries from 2026-02-25

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