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SummaryGeometryRelated PDB entries

A1CQL

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
O06C05doub1.21Å1.19Å
F19C18sing1.40Å1.37Å
C05C03sing1.51Å1.55Å
C05N07sing1.35Å1.49Å
C03C02sing1.53Å1.56Å
C03O04sing1.43Å1.41Å
C15C16doub1.38Å1.39ÅAromatic
C15C14sing1.38Å1.40ÅAromatic
C16C17sing1.38Å1.39ÅAromatic
C13C14sing1.51Å1.58Å
C13N07sing1.47Å1.40Å
C13C11sing1.50Å1.59Å
C14C23doub1.38Å1.41ÅAromatic
C02C01sing1.53Å1.54Å
C17C18sing1.51Å1.54Å
C17C22doub1.38Å1.40ÅAromatic
C18F21sing1.40Å1.37Å
C18F20sing1.40Å1.37Å
N07C08sing1.47Å1.42Å
O12C11doub1.21Å1.20Å
C23C22sing1.38Å1.40ÅAromatic
C11N10sing1.33Å1.52Å
C08C09sing1.53Å1.49Å
N10C09sing1.46Å1.52Å
C13H1sing1.09Å1.10Å
C15H2sing1.08Å1.08Å
C22H3sing1.08Å1.08Å
C01H4sing1.09Å1.10Å
C01H5sing1.09Å1.10Å
C01H6sing1.09Å1.10Å
C02H7sing1.09Å1.10Å
C02H8sing1.09Å1.10Å
C03H9sing1.09Å1.10Å
C08H10sing1.09Å1.10Å
C08H11sing1.09Å1.10Å
C09H12sing1.09Å1.10Å
C09H13sing1.09Å1.10Å
C16H14sing1.08Å1.08Å
C23H15sing1.08Å1.08Å
N10H16sing0.97Å1.00Å
O04H17sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
O06C05C03118.1°120.0°
O06C05N07118.4°120.0°
F19C18C17109.2°109.4°
F19C18F21109.3°109.5°
F19C18F20108.9°109.5°
C03C05N07123.5°120.0°
C05C03C02115.3°109.5°
C05C03O04108.6°109.5°
C05C03H9107.3°109.5°
C05N07C13119.9°121.4°
C05N07C08124.8°121.3°
C02C03O04109.1°109.4°
C03C02C01110.7°109.5°
C03C02H7109.1°109.5°
C03C02H8109.2°109.5°
C02C03H9107.3°109.4°
O04C03H9109.1°109.4°
C03O04H17109.5°114.0°
C16C15C14121.8°120.0°
C15C16C17120.0°120.0°
C16C15H2119.1°120.0°
C15C16H14120.0°120.0°
C15C14C13113.3°120.0°
C15C14C23117.4°120.0°
C14C15H2119.1°120.0°
C16C17C18118.1°120.0°
C16C17C22119.9°120.0°
C17C16H14120.0°120.0°
C14C13N07136.2°109.6°
C14C13C1186.9°109.5°
C13C14C23129.3°120.0°
C14C13H1104.4°109.5°
N07C13C11114.1°108.9°
C13N07C08115.3°117.3°
N07C13H1106.4°109.6°
C13C11O12123.5°118.5°
C13C11N10113.3°123.0°
C11C13H1104.4°109.7°
C14C23C22121.4°120.0°
C14C23H15119.3°120.0°
C02C01H4109.5°109.5°
C02C01H5109.5°109.4°
C02C01H6109.5°109.5°
C01C02H7109.1°109.5°
C01C02H8109.2°109.5°
C18C17C22122.0°120.0°
C17C18F21111.1°109.5°
C17C18F20109.0°109.5°
C17C22C23119.5°119.9°
C17C22H3120.3°120.0°
F21C18F20109.2°109.4°
N07C08C09116.8°108.2°
N07C08H10107.6°109.7°
N07C08H11107.6°109.7°
O12C11N10122.9°118.5°
C23C22H3120.3°120.0°
C22C23H15119.3°120.0°
C11N10C09111.2°124.6°
C11N10H16124.4°117.7°
C08C09N10112.3°110.8°
C09C08H10107.6°109.7°
C09C08H11107.6°109.8°
C08C09H12108.8°109.2°
C08C09H13108.8°109.2°
N10C09H12108.8°109.2°
N10C09H13108.8°109.2°
C09N10H16124.4°117.7°
H4C01H5109.5°109.4°
H4C01H6109.4°109.5°
H5C01H6109.5°109.5°
H7C02H8109.5°109.4°
H10C08H11109.5°109.7°
H12C09H13109.5°109.2°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
O06C05C03N07178.8°179.9°
O06C05C03C02116.6°115.0°
O06C05C03O04120.6°4.9°
O06C05N07C130.7°0.1°
O06C05N07C08179.2°180.0°
O06C05C03H92.8°125.0°
F19C18C17C1648.9°30.1°
F19C18C17F21120.6°120.0°
F19C18C17F20118.9°120.0°
F19C18C17C22131.2°150.0°
F19C18F21F20119.1°120.0°
C05C03C02O04122.4°120.0°
C05C03C02H9119.5°120.0°
C05C03O04H9116.7°120.1°
C03C05N07C13179.5°180.0°
C05C03C02C01172.1°175.0°
C03C05N07C080.4°0.0°
C05C03C02H767.7°65.0°
C05C03C02H851.9°55.0°
C05C03O04H17180.0°59.9°
N07C05C03C0264.5°65.0°
N07C05C03O0458.2°175.0°
C05N07C13C14113.1°102.9°
C05N07C13C08179.9°180.0°
C05N07C13C11134.5°137.2°
C05N07C08C09178.1°118.5°
C05N07C13H119.9°17.3°
N07C05C03H9176.0°54.9°
C05N07C08H1060.8°121.8°
C05N07C08H1157.1°1.2°
C02C03O04H9116.9°119.9°
C03C02C01H7120.2°120.0°
C03C02C01H8120.2°120.0°
C03C02C01H4180.0°180.0°
C03C02C01H560.0°60.0°
C03C02C01H660.0°60.0°
C03C02H7H8119.4°120.0°
C02C03O04H1753.6°60.1°
O04C03C02C0149.7°65.0°
O04C03C02H7169.8°55.1°
O04C03C02H870.5°175.0°
C16C15C14H2180.0°179.7°
C15C16C17H14180.0°180.0°
C16C15C14C13179.7°180.0°
C16C15C14C230.5°0.1°
C15C16C17C18179.9°180.0°
C15C16C17C220.0°0.1°
C14C15C16C170.3°0.1°
C15C14C13C23179.0°179.9°
C15C14C13N0740.4°63.5°
C15C14C13C11162.6°56.0°
C15C14C23C220.5°0.1°
C15C14C13H193.2°176.3°
C14C15C16H14179.7°180.0°
C15C14C23H15179.4°180.0°
C16C17C18C22179.9°179.9°
C16C17C18F21169.5°89.9°
C16C17C18F2070.1°150.1°
C16C17C22C230.0°0.1°
C17C16C15H2179.7°179.8°
C16C17C22H3180.0°180.0°
C14C13N07C11112.4°119.8°
C14C13N07H1133.1°120.2°
C14C13C11H1104.1°120.3°
C14C13N07C0867.0°77.1°
C14C13C11O1290.3°72.9°
C13C14C23C22179.5°180.0°
C14C13C11N1095.0°107.1°
C13C14C15H20.4°0.3°
C13C14C23H150.5°0.1°
N07C13C11H1115.7°119.9°
N07C13C14C23138.6°116.4°
N07C13C11O12129.5°167.3°
N07C13C11N1045.1°12.7°
C13N07C08C092.0°61.5°
C13N07C08H10119.1°58.2°
C13N07C08H11123.0°178.8°
C11C13C14C2316.3°124.1°
C11C13N07C0845.4°42.7°
C13C11O12N10174.1°180.0°
C13C11N10C092.5°4.3°
C13C11N10H16177.6°175.7°
C14C23C22C170.3°0.1°
C14C23C22H15180.0°179.9°
C23C14C13H187.8°3.8°
C23C14C15H2179.5°179.8°
C14C23C22H3179.7°180.0°
C02C01H4H5120.0°119.9°
C02C01H4H6120.0°120.1°
C02C01H5H6120.0°120.0°
C01C02H7H8119.4°120.0°
C01C02C03H968.4°54.9°
C17C18F21F20120.3°120.0°
C18C17C22C23179.9°180.0°
C18C17C22H30.1°0.1°
C18C17C16H140.1°0.0°
C22C17C18F2110.6°90.0°
C22C17C18F20109.9°30.0°
C17C22C23H3180.0°180.0°
C22C17C16H14180.0°180.0°
C17C22C23H15179.7°180.0°
N07C08C09H10121.1°119.6°
N07C08C09H11121.1°119.7°
N07C08C09N1050.8°46.7°
C08N07C13H1159.9°162.7°
N07C08H10H11116.7°120.6°
N07C08C09H12171.2°73.6°
N07C08C09H1369.6°167.0°
O12C11N10C09177.1°175.7°
O12C11C13H113.8°47.4°
O12C11N10H162.9°4.3°
C11N10C09C0847.3°21.9°
C11N10C09H16180.0°180.0°
N10C11C13H1160.8°132.6°
C11N10C09H12167.7°98.4°
C11N10C09H1373.1°142.2°
C08C09N10H12120.4°120.3°
C08C09N10H13120.4°120.3°
C09C08H10H11116.7°120.7°
C08C09H12H13118.7°119.4°
C08C09N10H16132.7°158.1°
N10C09C08H1070.2°72.9°
N10C09C08H11171.9°166.4°
N10C09H12H13118.7°119.4°
H2C15C16H140.3°0.2°
H3C22C23H150.3°0.0°
H4C01H5H6120.0°120.1°
H4C01C02H759.8°59.9°
H4C01C02H859.8°60.1°
H5C01C02H7179.8°60.0°
H5C01C02H860.2°180.0°
H6C01C02H760.1°180.0°
H6C01C02H8179.8°60.0°
H7C02C03H951.8°175.0°
H8C02C03H9171.4°65.0°
H9C03O04H1763.3°180.0°
H10C08C09H1250.2°166.8°
H10C08C09H13169.3°47.4°
H11C08C09H1267.7°46.1°
H11C08C09H1351.5°73.3°
H12C09N10H1612.3°81.6°
H13C09N10H16106.9°37.8°

254227

PDB entries from 2026-05-27

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